Detailed information for compound 1472457

Basic information

Technical information
  • TDR Targets ID: 1472457
  • Name: [2-[[4-(ethyl-propan-2-ylamino)phenyl]amino]- 2-oxoethyl] quinoline-2-carboxylate
  • MW: 391.463 | Formula: C23H25N3O3
  • H donors: 1 H acceptors: 3 LogP: 4.57 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(c1ccc(cc1)NC(=O)COC(=O)c1ccc2c(n1)cccc2)C(C)C
  • InChi: 1S/C23H25N3O3/c1-4-26(16(2)3)19-12-10-18(11-13-19)24-22(27)15-29-23(28)21-14-9-17-7-5-6-8-20(17)25-21/h5-14,16H,4,15H2,1-3H3,(H,24,27)
  • InChiKey: DHBJXHQJJIUZAD-UHFFFAOYSA-N  


Substructure search Similarity search

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Synonyms

  • [2-[[4-(ethyl-isopropyl-amino)phenyl]amino]-2-oxo-ethyl] quinoline-2-carboxylate
  • 2-quinolinecarboxylic acid [2-[[4-(ethyl-isopropylamino)phenyl]amino]-2-oxoethyl] ester
  • quinaldic acid [2-[[4-(ethyl-isopropyl-amino)phenyl]amino]-2-keto-ethyl] ester
  • [2-[[4-(ethyl-propan-2-yl-amino)phenyl]amino]-2-oxo-ethyl] quinoline-2-carboxylate
  • Oprea1_780256
  • SMR000152299
  • MLS000565050
  • ZINC03317979
  • T0516-2507

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glutaminase Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Photinus pyralis Luciferin 4-monooxygenase Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 1, subfamily A, polypeptide 2 Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 2, subfamily C, polypeptide 19 Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 2, subfamily C, polypeptide 9 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium ulcerans acyl-CoA synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans acyl-CoA synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania mexicana 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans fatty-acid-CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania donovani 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi AMP-binding enzyme family protein Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania braziliensis 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma mansoni glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
Leishmania mexicana 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania mexicana 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania infantum 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Entamoeba histolytica acyl-CoA synthetase, putative Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium ulcerans glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) Get druggable targets OG5_126609 All targets in OG5_126609
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Plasmodium knowlesi acyl-CoA synthetase, putative Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania major 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Onchocerca volvulus Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania major 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Plasmodium falciparum acyl-CoA synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania infantum 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Entamoeba histolytica acyl-coA synthetase, putative Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium ulcerans long-chain fatty-acid CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania donovani 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium ulcerans acyl-CoA synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium ulcerans fatty-acid-CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania major 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Brugia malayi AMP-binding enzyme family protein Get druggable targets OG5_126609 All targets in OG5_126609
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Plasmodium vivax acyl-CoA synthetase, putative Get druggable targets OG5_126609 All targets in OG5_126609
Plasmodium yoelii peroxisomal-coenzyme a synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Brugia malayi AMP-binding enzyme family protein Get druggable targets OG5_126609 All targets in OG5_126609
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania infantum 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Get druggable targets OG5_126609 All targets in OG5_126609
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase Get druggable targets OG5_126609 All targets in OG5_126609
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi glutaminase DH11.1 Get druggable targets OG5_129245 All targets in OG5_129245
Plasmodium berghei acyl-CoA synthetase, putative Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Entamoeba histolytica acyl-CoA synthetase, putative Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium ulcerans hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania infantum 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trichomonas vaginalis glutaminase, putative Get druggable targets OG5_129245 All targets in OG5_129245
Loa Loa (eye worm) glutaminase 2 Get druggable targets OG5_129245 All targets in OG5_129245
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD28 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 484 aa 20.5 %
Dictyostelium discoideum acetyl-CoA ligase Luciferin 4-monooxygenase   550 aa 549 aa 22.2 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 497 aa 19.3 %
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD32 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase). Also shown to have acyl-ACP ligase activity. Luciferin 4-monooxygenase   550 aa 487 aa 22.4 %
Trichomonas vaginalis antibiotic synthetase, putative Luciferin 4-monooxygenase   550 aa 577 aa 22.2 %
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD29 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 529 aa 22.3 %
Candida albicans similar to S. cerevisiae FAA4 (YMR246W) long-chain fatty acid--CoA synthetase Luciferin 4-monooxygenase   550 aa 478 aa 23.4 %
Trichomonas vaginalis AMP dependent CoA ligase, putative Luciferin 4-monooxygenase   550 aa 524 aa 24.0 %
Candida albicans similar to S. cerevisiae ACS2 (YLR153C) acetyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 539 aa 22.1 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 526 aa 22.4 %
Trichomonas vaginalis antibiotic synthetase, putative Luciferin 4-monooxygenase   550 aa 581 aa 21.2 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 538 aa 21.8 %
Onchocerca volvulus Lysine-specific histone demethylase 1A homolog Luciferin 4-monooxygenase   550 aa 550 aa 22.5 %
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD26 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 560 aa 21.4 %
Cryptosporidium parvum putative long chain fatty acyl CoA synthetase having a signal peptide Luciferin 4-monooxygenase   550 aa 472 aa 24.8 %
Mycobacterium ulcerans non-ribosomal peptide synthetase Luciferin 4-monooxygenase   550 aa 541 aa 22.4 %
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase Luciferin 4-monooxygenase   550 aa 536 aa 24.4 %
Mycobacterium ulcerans fatty-acid-CoA ligase FadD9 Luciferin 4-monooxygenase   550 aa 463 aa 21.8 %
Mycobacterium leprae PROBABLE FATTY-ACID--CoA LIGASE FADD21 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) Luciferin 4-monooxygenase   550 aa 565 aa 22.8 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 601 aa 22.5 %
Dictyostelium discoideum AMP-dependent synthetase and ligase domain-containing protein Luciferin 4-monooxygenase   550 aa 517 aa 24.8 %
Leishmania mexicana long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 483 aa 23.8 %
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 Luciferin 4-monooxygenase   550 aa 493 aa 22.1 %
Echinococcus multilocularis long chain fatty acid coenzyme A ligase 1 Luciferin 4-monooxygenase   550 aa 443 aa 26.4 %
Schistosoma japonicum ko:K08745 solute carrier family 27 (fatty acid transporter), member 1, putative Luciferin 4-monooxygenase   550 aa 501 aa 24.6 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 539 aa 19.1 %
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein Luciferin 4-monooxygenase   550 aa 476 aa 22.5 %
Trypanosoma brucei gambiense fatty acyl CoA synthetase 3 Luciferin 4-monooxygenase   550 aa 491 aa 23.6 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 542 aa 18.3 %
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD28 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 504 aa 22.6 %
Candida albicans similar to S. cerevisiae ACS2 (YLR153C) acetyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 543 aa 24.5 %
Candida albicans similar to S. cerevisiae ACS2 (YLR153C) acetyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 539 aa 22.1 %
Echinococcus multilocularis long chain fatty acid coenzyme A ligase 5 Luciferin 4-monooxygenase   550 aa 458 aa 25.5 %
Leishmania braziliensis acetyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 596 aa 21.1 %
Trichomonas vaginalis long-chain-fatty-acid CoA ligase, putative Luciferin 4-monooxygenase   550 aa 466 aa 21.7 %
Brugia malayi Cytochrome P450 family protein cytochrome P450, family 1, subfamily A, polypeptide 2 516 aa 470 aa 26.2 %
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD32 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 442 aa 23.5 %
Leishmania donovani long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 500 aa 23.4 %
Leishmania braziliensis long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 496 aa 22.8 %
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 480 aa 22.5 %
Trypanosoma brucei fatty acyl CoA synthetase 3 Luciferin 4-monooxygenase   550 aa 491 aa 23.6 %
Leishmania major long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 482 aa 23.2 %
Mycobacterium leprae FATTY-ACID-CoA LIGASE FADD26 (FATTY-ACID-COA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) Luciferin 4-monooxygenase   550 aa 533 aa 22.7 %
Trypanosoma cruzi fatty acyl CoA synthetase 2, putative Luciferin 4-monooxygenase   550 aa 495 aa 22.6 %
Echinococcus multilocularis long chain fatty acid transport protein 4 Luciferin 4-monooxygenase   550 aa 476 aa 22.3 %
Onchocerca volvulus Matrilysin homolog Luciferin 4-monooxygenase   550 aa 466 aa 24.2 %
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative Luciferin 4-monooxygenase   550 aa 476 aa 20.8 %
Trypanosoma cruzi fatty acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 482 aa 24.7 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 541 aa 21.4 %
Onchocerca volvulus Luciferin 4-monooxygenase   550 aa 487 aa 23.8 %
Trypanosoma congolense fatty acyl CoA synthetase 2, putative Luciferin 4-monooxygenase   550 aa 500 aa 22.4 %
Loa Loa (eye worm) AMP-binding enzyme family protein Luciferin 4-monooxygenase   550 aa 489 aa 23.3 %
Dictyostelium discoideum AMP-dependent synthetase and ligase domain-containing protein Luciferin 4-monooxygenase   550 aa 550 aa 20.9 %
Mycobacterium ulcerans fatty-acid-CoA ligase FadD11 Luciferin 4-monooxygenase   550 aa 498 aa 23.5 %
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative Luciferin 4-monooxygenase   550 aa 494 aa 23.9 %
Trichomonas vaginalis long-chain-fatty-acid CoA ligase, putative Luciferin 4-monooxygenase   550 aa 490 aa 23.3 %
Dictyostelium discoideum AMP-dependent synthetase and ligase domain-containing protein Luciferin 4-monooxygenase   550 aa 545 aa 24.9 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 494 aa 24.3 %
Echinococcus granulosus long chain fatty acid transport protein 4 Luciferin 4-monooxygenase   550 aa 476 aa 22.3 %
Neospora caninum acetyl-coenzyme a synthetase, putative Luciferin 4-monooxygenase   550 aa 549 aa 20.9 %
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase FadD15 Luciferin 4-monooxygenase   550 aa 482 aa 24.3 %
Mycobacterium leprae Probable long-chain-fatty-acid-CoA ligase FadD15 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) Luciferin 4-monooxygenase   550 aa 484 aa 23.3 %
Echinococcus granulosus long chain fatty acid coenzyme A ligase 1 Luciferin 4-monooxygenase   550 aa 452 aa 26.1 %
Cryptosporidium hominis acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 460 aa 26.1 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 478 aa 21.1 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 535 aa 21.7 %
Leishmania major cytochrome p450-like protein cytochrome P450, family 2, subfamily C, polypeptide 19 490 aa 411 aa 23.1 %
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase FadD15 Luciferin 4-monooxygenase   550 aa 484 aa 26.0 %
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) Luciferin 4-monooxygenase   550 aa 535 aa 23.2 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 463 aa 23.5 %
Mycobacterium tuberculosis Probable fatty-acid-AMP ligase FadD25 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 475 aa 21.1 %
Trichomonas vaginalis AMP dependent CoA ligase, putative Luciferin 4-monooxygenase   550 aa 492 aa 23.6 %
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 505 aa 28.1 %
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD29 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 617 aa 22.2 %
Echinococcus multilocularis long chain fatty acid coenzyme A ligase 1 Luciferin 4-monooxygenase   550 aa 459 aa 27.0 %
Trichomonas vaginalis AMP dependent CoA ligase, putative Luciferin 4-monooxygenase   550 aa 527 aa 25.0 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 542 aa 22.1 %
Toxoplasma gondii type I fatty acid synthase, putative Luciferin 4-monooxygenase   550 aa 514 aa 19.8 %
Candida albicans similar to S. cerevisiae FAT1 (YBR041W) fatty acid transporter and very long-chain fatty acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 496 aa 24.2 %
Leishmania braziliensis acetyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 603 aa 22.6 %
Mycobacterium tuberculosis Probable fatty-acid-AMP ligase FadD21 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 586 aa 24.4 %
Dictyostelium discoideum fatty acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 501 aa 24.4 %
Mycobacterium tuberculosis Probable fatty-acid-AMP ligase FadD24 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 526 aa 21.9 %
Babesia bovis long-chain acyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 445 aa 21.8 %
Leishmania braziliensis long-chain-fatty-acid-CoA ligase, putative Luciferin 4-monooxygenase   550 aa 504 aa 25.6 %
Dictyostelium discoideum AMP-dependent synthetase and ligase domain-containing protein Luciferin 4-monooxygenase   550 aa 531 aa 19.0 %
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative Luciferin 4-monooxygenase   550 aa 480 aa 21.5 %
Entamoeba histolytica acyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 446 aa 22.0 %
Leishmania mexicana acetyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 559 aa 20.6 %
Trichomonas vaginalis AMP dependent ligase, putative Luciferin 4-monooxygenase   550 aa 445 aa 26.1 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 593 aa 22.1 %
Candida albicans similar to S. cerevisiae ACS2 (YLR153C) acetyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 543 aa 24.5 %
Mycobacterium tuberculosis Probable acyl-CoA ligase FadD31 (acyl-CoA synthetase) (acyl-CoA synthase) Luciferin 4-monooxygenase   550 aa 592 aa 20.4 %
Leishmania infantum long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 500 aa 23.4 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 576 aa 19.8 %
Mycobacterium leprae Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 461 aa 22.3 %
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD34 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 537 aa 20.9 %
Cryptosporidium parvum acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 460 aa 25.7 %
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 541 aa 21.6 %
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE Luciferin 4-monooxygenase   550 aa 502 aa 22.5 %
Echinococcus granulosus long chain fatty acid coenzyme A ligase 5 Luciferin 4-monooxygenase   550 aa 458 aa 25.8 %
Mycobacterium ulcerans putative fatty-acid--CoA ligase Luciferin 4-monooxygenase   550 aa 576 aa 20.8 %
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase Luciferin 4-monooxygenase   550 aa 509 aa 21.8 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 507 aa 20.9 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 582 aa 22.3 %
Schistosoma japonicum ko:K01897 long-chain fatty-acid-CoA ligase [EC6.2.1.3], putative Luciferin 4-monooxygenase   550 aa 466 aa 27.3 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 541 aa 21.6 %
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 cytochrome P450, family 2, subfamily C, polypeptide 9 490 aa 441 aa 21.8 %
Brugia malayi AMP-binding enzyme family protein Luciferin 4-monooxygenase   550 aa 497 aa 24.7 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 558 aa 20.4 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 522 aa 19.9 %
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) Luciferin 4-monooxygenase   550 aa 509 aa 22.6 %
Cryptosporidium parvum acetyl-coenzyme A synthetase Luciferin 4-monooxygenase   550 aa 545 aa 22.8 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 538 aa 21.8 %
Schistosoma japonicum ko:K01897 long-chain fatty-acid-CoA ligase [EC6.2.1.3], putative Luciferin 4-monooxygenase   550 aa 541 aa 22.4 %
Candida albicans similar to S. cerevisiae FAT1 (YBR041W) fatty acid transporter and very long-chain fatty acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 496 aa 24.2 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 541 aa 21.4 %
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF Luciferin 4-monooxygenase   550 aa 558 aa 20.1 %
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase, FadD11 Luciferin 4-monooxygenase   550 aa 492 aa 24.6 %
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD22 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 493 aa 20.7 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 554 aa 24.4 %
Dictyostelium discoideum fatty acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 462 aa 23.8 %
Trypanosoma cruzi fatty acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 480 aa 25.2 %
Cryptosporidium hominis acetyl-CoenzymeA synthetase (acetate--coa ligase) (acyl-activating enzyme) Luciferin 4-monooxygenase   550 aa 549 aa 22.6 %
Mycobacterium tuberculosis Probable fatty-acid-AMP ligase FadD23 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 542 aa 23.8 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 539 aa 19.1 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 554 aa 22.9 %
Brugia malayi AMP-binding enzyme family protein Luciferin 4-monooxygenase   550 aa 544 aa 21.5 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 542 aa 22.1 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 522 aa 19.9 %
Toxoplasma gondii propionate-CoA ligase Luciferin 4-monooxygenase   550 aa 550 aa 21.1 %
Trypanosoma brucei gambiense fatty acyl CoA synthetase 4, putative Luciferin 4-monooxygenase   550 aa 497 aa 23.7 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 542 aa 18.3 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 535 aa 22.6 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 530 aa 23.8 %
Theileria parva long-chain fatty acid CoA ligase, putative Luciferin 4-monooxygenase   550 aa 507 aa 23.5 %
Onchocerca volvulus Luciferin 4-monooxygenase   550 aa 502 aa 24.9 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 476 aa 23.5 %
Neospora caninum Short-chain dehydrogenase/reductase SDR, related Luciferin 4-monooxygenase   550 aa 518 aa 19.1 %
Babesia bovis fatty acyl-CoA synthetase family protein Luciferin 4-monooxygenase   550 aa 461 aa 23.4 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 499 aa 19.2 %
Schistosoma mansoni FAA1 Long-chain-fatty-acid--CoA ligase 1 Luciferin 4-monooxygenase   550 aa 494 aa 26.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi cysteine peptidase, putative 0.0068 0.0713 1
Brugia malayi Cytochrome P450 family protein 0.0059 0.0586 0.1346
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0025 0.0111 0.022
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) cysteine protease 0.0018 0.0016 0.0017
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Mycobacterium ulcerans glutaminase 0.033 0.4354 1
Schistosoma mansoni hypothetical protein 0.0676 0.9157 0.9157
Leishmania major cathepsin L-like protease 0.0018 0.0016 0.02
Echinococcus granulosus lipoxygenase domain containing protein 0.0021 0.006 0.006
Echinococcus multilocularis lipoxygenase domain containing protein 0.0021 0.006 0.006
Echinococcus granulosus small conductance calcium activated potassium 0.0676 0.9157 0.9157
Leishmania major calcium/potassium channel (CAKC), putative 0.0025 0.0111 0.1414
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.002 0.0048 0.0029
Leishmania major cathepsin L-like protease 0.0068 0.0713 0.9073
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.002 0.0048 0.0029
Schistosoma mansoni lipoxygenase 0.0059 0.0586 0.0586
Echinococcus granulosus potassium channel subfamily K 8 0.0025 0.0111 0.0111
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0786 0.0786
Echinococcus multilocularis cathepsin L cysteine protease 0.0018 0.0016 0.0016
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0165 0.038
Schistosoma mansoni twik family of potassium channels-related 0.0025 0.0111 0.0111
Plasmodium falciparum cysteine proteinase falcipain 3 0.0018 0.0016 0.1414
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0025 0.0111 0.022
Onchocerca volvulus 0.0025 0.0111 0.6382
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0786 0.1718
Schistosoma mansoni twik family of potassium channels-related 0.0025 0.0111 0.0111
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0786 0.0786
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 28 0.0025 0.0111 0.0255
Echinococcus multilocularis potassium channel subfamily K 0.0025 0.0111 0.0111
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0029 0.0165 0.5
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0786 0.0786
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0018 0.0016 0.1414
Schistosoma mansoni rab6-interacting 0.0021 0.006 0.006
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0018 0.0016 0.0017
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.0786 1
Plasmodium vivax vivapain-2 0.0018 0.0016 0.1414
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0165 0.038
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0165 0.0276
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.002 0.0048 0.0029
Schistosoma mansoni calcium-activated potassium channel 0.0025 0.0111 0.0111
Mycobacterium ulcerans ion transport protein 0.0025 0.0111 0.0151
Loa Loa (eye worm) hypothetical protein 0.0228 0.2939 0.321
Entamoeba histolytica acyl-coA synthetase, putative 0.0029 0.0165 1
Echinococcus granulosus potassium channel subfamily K 8 0.0025 0.0111 0.0111
Echinococcus granulosus Polycystic kidney disease protein 0.0021 0.006 0.006
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0046 0.0649
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0046 0.0071
Loa Loa (eye worm) hypothetical protein 0.0021 0.0065 0.0071
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Echinococcus multilocularis potassium channel subfamily K 8 0.0025 0.0111 0.0111
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 19. C. elegans unc-58 ortholog 0.0025 0.0111 0.0255
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 21 0.0025 0.0111 0.0255
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0046 0.2046
Leishmania major cathepsin L-like protease 0.0068 0.0713 0.9073
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0063 0.064 0.064
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Toxoplasma gondii exonuclease III APE 0.002 0.0046 0.0589
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0063 0.064 0.064
Echinococcus multilocularis potassium channel subfamily K 8 0.0025 0.0111 0.0111
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0025 0.0111 0.1558
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0029 0.0165 0.0276
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Schistosoma mansoni cathepsin F (C01 family) 0.0018 0.0016 0.0016
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0029 0.0165 0.0276
Plasmodium falciparum LCCL domain-containing protein 0.0021 0.006 0.538
Brugia malayi Cathepsin L-like precursor 0.0018 0.0016 0.0036
Leishmania major cathepsin L-like protease 0.0018 0.0016 0.02
Entamoeba histolytica acyl-CoA synthetase, putative 0.0029 0.0165 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Brugia malayi hypothetical protein 0.0021 0.006 0.0137
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 24 0.0025 0.0111 0.0255
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0046 0.5
Loa Loa (eye worm) large conductance calcium-activated potassium channel alpha subunit ai 0.0025 0.0111 0.0121
Echinococcus granulosus lysine specific demethylase 5A 0.0063 0.064 0.064
Loa Loa (eye worm) fibroinase 0.0018 0.0016 0.0017
Leishmania major 4-coumarate:coa ligase-like protein 0.0029 0.0165 0.2102
Entamoeba histolytica acyl-CoA synthetase, putative 0.0029 0.0165 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0016 0.0017
Plasmodium vivax vivapain-2 0.0018 0.0016 0.1414
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Trypanosoma cruzi cysteine peptidase, putative 0.0068 0.0713 1
Brugia malayi jmjC domain containing protein 0.0063 0.064 0.1469
Trichomonas vaginalis glutaminase, putative 0.033 0.4354 1
Echinococcus multilocularis TWiK family of potassium channels protein 7 0.0025 0.0111 0.0111
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0786 0.1718
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0165 0.0276
Loa Loa (eye worm) hypothetical protein 0.0029 0.0165 0.018
Echinococcus granulosus calcium activated potassium channel variant 0.0025 0.0111 0.0111
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Echinococcus granulosus RUN 0.0021 0.006 0.006
Loa Loa (eye worm) TWK-7 protein 0.0025 0.0111 0.0121
Echinococcus granulosus cathepsin l cysteine peptidase 0.0018 0.0016 0.0016
Onchocerca volvulus 0.0025 0.0111 0.6382
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0046 0.0649
Mycobacterium ulcerans transmembrane cation transporter 0.0025 0.0111 0.0151
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 17 0.0025 0.0111 0.0255
Brugia malayi hypothetical protein 0.0021 0.006 0.0137
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0046 0.4166
Echinococcus granulosus twik family of potassium channels 0.0025 0.0111 0.0111
Entamoeba histolytica calcium-gated potassium channel protein, putative 0.0025 0.0111 0.6382
Brugia malayi hypothetical protein 0.0025 0.0111 0.0255
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0029 0.0165 0.0276
Toxoplasma gondii ion channel protein 0.0025 0.0111 0.1414
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0046 0.4166
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 38. C. elegans sup-9 ortholog 0.0025 0.0111 0.0255
Trypanosoma brucei calcium-activated potassium channel, putative 0.0025 0.0111 0.1558
Leishmania major ion transport protein-like protein 0.0025 0.0111 0.1414
Echinococcus multilocularis cysteine protease 0.0018 0.0016 0.0016
Loa Loa (eye worm) hypothetical protein 0.0021 0.0065 0.0071
Plasmodium vivax acyl-CoA synthetase, putative 0.0021 0.0065 0.5819
Echinococcus multilocularis cysteine protease 0.0018 0.0016 0.0016
Echinococcus granulosus TWiK family of potassium channels protein 7 0.0025 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0021 0.0065 0.0071
Echinococcus multilocularis Two pore potassium channel protein sup 9 0.0025 0.0111 0.0111
Brugia malayi glutaminase DH11.1 0.033 0.4354 1
Leishmania major cathepsin L-like protease 0.0018 0.0016 0.02
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Plasmodium falciparum acyl-CoA synthetase 0.0021 0.0065 0.5819
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39B 0.0025 0.0111 0.0255
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39A 0.0025 0.0111 0.0255
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0025 0.0111 0.1558
Echinococcus multilocularis small conductance calcium activated potassium 0.0676 0.9157 0.9157
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0029 0.0165 0.0276
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 35 0.0025 0.0111 0.0255
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0046 0.0046
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0046 0.0051
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Echinococcus multilocularis calcium activated potassium channel variant 0.0025 0.0111 0.0111
Plasmodium vivax potassium channel, putative 0.0025 0.0111 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Plasmodium falciparum potassium channel 0.0025 0.0111 1
Plasmodium vivax potassium channel, putative 0.0025 0.0111 1
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 7 0.0025 0.0111 0.0255
Brugia malayi Cathepsin L-like precursor 0.0018 0.0016 0.0036
Echinococcus multilocularis twik family of potassium channels 0.0025 0.0111 0.0111
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 30. 0.0025 0.0111 0.0255
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0062 0.0631 0.8849
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Onchocerca volvulus 0.0025 0.0111 0.6382
Trypanosoma cruzi major cysteine proteinase, putative 0.0054 0.0511 0.7162
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.002 0.0048 0.0029
Brugia malayi Cathepsin L-like precursor 0.0018 0.0016 0.0036
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0025 0.0111 0.022
Echinococcus granulosus Two pore potassium channel protein sup 9 0.0025 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Schistosoma mansoni ap endonuclease 0.002 0.0046 0.0046
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0786 0.0786
Loa Loa (eye worm) TWK-28 protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) hypothetical protein 0.0021 0.0065 0.0071
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0046 0.0046
Echinococcus multilocularis RUN 0.0021 0.006 0.006
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Schistosoma mansoni twik family of potassium channels-related 0.0025 0.0111 0.0111
Loa Loa (eye worm) jmjC domain-containing protein 0.0063 0.064 0.0698
Schistosoma mansoni microtubule-associated protein tau 0.0736 1 1
Schistosoma mansoni polycystin 1-related 0.0021 0.006 0.006
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 5 0.0025 0.0111 0.0255
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0165 0.0276
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Onchocerca volvulus 0.0025 0.0111 0.6382
Plasmodium falciparum potassium channel 0.0025 0.0111 1
Trypanosoma cruzi ion transport protein, putative 0.0025 0.0111 0.1558
Brugia malayi jmjC domain containing protein 0.0063 0.064 0.1469
Loa Loa (eye worm) hypothetical protein 0.0021 0.006 0.0065
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Schistosoma mansoni calcium-activated potassium channel 0.0483 0.6474 0.6474
Onchocerca volvulus 0.0029 0.0165 1
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0021 0.0065 0.5
Schistosoma mansoni ap endonuclease 0.002 0.0046 0.0046
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0046 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0018 0.0016 0.0016
Loa Loa (eye worm) uncoordinated protein 58 0.0025 0.0111 0.0121
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0021 0.0065 0.0043
Brugia malayi Cathepsin L-like precursor 0.0018 0.0016 0.0036
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0025 0.0111 0.1558
Plasmodium vivax multidomain scavenger receptor, putative 0.0021 0.006 0.538
Toxoplasma gondii cathepsin CPL 0.0018 0.0016 0.02
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Trypanosoma cruzi hypothetical protein, conserved 0.0025 0.0111 0.1558
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0029 0.0165 0.1607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0165 0.038
Schistosoma mansoni rab6-interacting 0.0021 0.006 0.006
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0021 0.0065 0.0248
Loa Loa (eye worm) hypothetical protein 0.0021 0.0065 0.0071
Schistosoma mansoni twik family of potassium channels-related 0.0025 0.0111 0.0111
Loa Loa (eye worm) S-phase kinase-associated protein 1A 0.0025 0.0111 0.0121
Trypanosoma cruzi cysteine peptidase, putative 0.0018 0.0016 0.022
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Leishmania major 4-coumarate:coa ligase-like protein 0.0029 0.0165 0.2102
Brugia malayi hypothetical protein 0.0025 0.0111 0.0255
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.0786 1
Schistosoma mansoni calcium-activated potassium channel 0.0025 0.0111 0.0111
Trypanosoma cruzi hypothetical protein, conserved 0.0025 0.0111 0.1558
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0046 0.0649
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 32 0.0025 0.0111 0.0255
Onchocerca volvulus 0.0021 0.006 0.2948
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 13 0.0025 0.0111 0.0255
Onchocerca volvulus 0.0025 0.0111 0.6382
Leishmania major hypothetical protein, conserved 0.0025 0.0111 0.1414
Loa Loa (eye worm) hypothetical protein 0.0021 0.006 0.0065
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Leishmania major hypothetical protein, conserved 0.0025 0.0111 0.1414
Leishmania major potassium channel subunit-like protein 0.0025 0.0111 0.1414
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Schistosoma mansoni hypothetical protein 0.0021 0.006 0.006
Echinococcus granulosus cathepsin L cysteine proteinase 0.0018 0.0016 0.0016
Onchocerca volvulus 0.0021 0.006 0.2948
Leishmania major cathepsin L-like protease 0.0018 0.0016 0.02
Trypanosoma brucei calcium/potassium channel (CAKC), putative 0.0025 0.0111 0.1558
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.0786 1
Giardia lamblia Hypothetical protein 0.0025 0.0111 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 12 0.0025 0.0111 0.0255
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Schistosoma mansoni twik family of potassium channels-related 0.0025 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) hypothetical protein 0.0029 0.0165 0.018
Loa Loa (eye worm) hypothetical protein 0.0168 0.2106 0.2301
Loa Loa (eye worm) glutaminase 2 0.033 0.4354 0.4755
Mycobacterium ulcerans hypothetical protein 0.0029 0.0165 0.0276
Toxoplasma gondii ion channel protein 0.0025 0.0111 0.1414
Echinococcus multilocularis lipoxygenase domain containing protein 0.0021 0.006 0.006
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Schistosoma mansoni calcium-activated potassium channel 0.0676 0.9157 0.9157
Echinococcus multilocularis twik family of potassium channels 0.0025 0.0111 0.0111
Brugia malayi Doublecortin family protein 0.0021 0.006 0.0137
Leishmania major cysteine peptidase A (CPA) 0.0018 0.0016 0.02
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 45 0.0025 0.0111 0.0255
Loa Loa (eye worm) doublecortin family protein 0.0021 0.006 0.0065
Loa Loa (eye worm) glutaminase 0.033 0.4354 0.4755
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0018 0.0016 0.0016
Schistosoma mansoni cathepsin F (C01 family) 0.0018 0.0016 0.0016
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0029 0.0165 0.5
Loa Loa (eye worm) ctsf protein 0.0018 0.0016 0.0017
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0046 0.0106
Schistosoma mansoni jumonji/arid domain-containing protein 0.0063 0.064 0.064
Echinococcus multilocularis microtubule associated protein 2 0.0736 1 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0165 0.1607
Trypanosoma cruzi ion transport protein, putative 0.0025 0.0111 0.1558
Echinococcus granulosus potassium channel subfamily K 0.0025 0.0111 0.0111
Echinococcus granulosus twik family of potassium channels 0.0025 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) potassium voltage-gated channel subfamily Q member 5 0.0025 0.0111 0.0121
Leishmania major cathepsin L-like protease 0.0018 0.0016 0.02
Brugia malayi Twik (KCNK-like) family of potasium channels, alpha subunit 40 0.0025 0.0111 0.0255
Loa Loa (eye worm) cytochrome P450 family protein 0.0059 0.0586 0.064
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0046 0.0071
Echinococcus multilocularis lysine specific demethylase 5A 0.0063 0.064 0.064
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0059 0.0586 0.0586
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0025 0.0111 0.1558
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0025 0.0111 0.022
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0786 0.1718
Onchocerca volvulus 0.0025 0.0111 0.6382
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0063 0.064 0.064
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0046 0.0589
Onchocerca volvulus 0.0025 0.0111 0.6382
Loa Loa (eye worm) hypothetical protein 0.0254 0.3302 0.3606
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Echinococcus multilocularis Polycystic kidney disease protein 0.0021 0.006 0.006
Brugia malayi Cathepsin L-like precursor 0.0018 0.0016 0.0036
Brugia malayi Papain family cysteine protease containing protein 0.0018 0.0016 0.0036
Echinococcus granulosus cathepsin l1 0.0018 0.0016 0.0016
Leishmania major cathepsin L-like protease 0.0068 0.0713 0.9073
Schistosoma mansoni jumonji domain containing protein 0.0063 0.064 0.064
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0059 0.0586 0.0586
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0018 0.0016 0.1414
Brugia malayi Cathepsin L-like precursor 0.0018 0.0016 0.0036
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0018 0.0016 0.0017
Loa Loa (eye worm) hypothetical protein 0.0676 0.9157 1
Schistosoma mansoni twik family of potassium channels-related 0.0025 0.0111 0.0111
Trypanosoma cruzi cruzipain precursor, putative 0.0068 0.0713 1
Schistosoma mansoni twik family of potassium channels-related 0.0025 0.0111 0.0111
Echinococcus granulosus lipoxygenase domain containing protein 0.0021 0.006 0.006
Echinococcus multilocularis cathepsin L cysteine protease 0.0018 0.0016 0.0016
Mycobacterium tuberculosis Possible transmembrane cation transporter 0.0025 0.0111 0.0876
Schistosoma mansoni loxhd1 0.0021 0.006 0.006
Schistosoma mansoni hypothetical protein 0.0025 0.0111 0.0111
Onchocerca volvulus 0.0025 0.0111 0.6382
Schistosoma mansoni twik family of potassium channels-related 0.0025 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0029 0.0165 0.018
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0025 0.0111 0.022
Loa Loa (eye worm) hypothetical protein 0.0025 0.0111 0.0121
Schistosoma mansoni glutaminase 0.033 0.4354 0.4354
Trypanosoma cruzi cysteine peptidase, putative 0.0068 0.0713 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0068 0.0713 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0029 0.0165 0.2102
Schistosoma mansoni lipoxygenase 0.0021 0.006 0.006

Activities

Activity type Activity value Assay description Source Reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2d6 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 2.511886432 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp1a2 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 4.466835922 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 19.95262315 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c9 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 39.81071706 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
IC50 (functional) 93.549 uM PUBCHEM_BIOASSAY: Discovery of Small Molecule Probes for H1N1 Influenza NS1A. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504399] ChEMBL. No reference
Potency (functional) 14.1254 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 15.1014 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) 15.8489 uM PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 19.9526 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 22.3872 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (binding) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) 32.6294 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (binding) = 39.8107 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of L3MBTL1. (Class of assay: confirmatory) [Related pubchem assays: 485292 (Probe Development Summary for Inhibitors of L3MBTL1)] ChEMBL. No reference
Potency (functional) 39.8107 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 95.2834 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23
Homo sapiens ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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