Detailed information for compound 1370031

Basic information

Technical information
  • TDR Targets ID: 1370031
  • Name: (2-methylamino-1,3-thiazol-5-yl)-phenylmethan one
  • MW: 218.275 | Formula: C11H10N2OS
  • H donors: 1 H acceptors: 2 LogP: 2.95 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CNc1ncc(s1)C(=O)c1ccccc1
  • InChi: 1S/C11H10N2OS/c1-12-11-13-7-9(15-11)10(14)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,13)
  • InChiKey: ACIORWSBZIKYKH-UHFFFAOYSA-N  


Substructure search Similarity search

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Synonyms

  • (2-methylaminothiazol-5-yl)-phenyl-methanone
  • (2-methylamino-5-thiazolyl)-phenylmethanone
  • (2-methylamino-1,3-thiazol-5-yl)-phenyl-methanone
  • ZINC01399949
  • MLS000543210
  • SMR000169179
  • [2-(methylamino)-1,3-thiazol-5-yl](phenyl)methanone
  • Bionet2_000004
  • 8D-017
  • Oprea1_827677

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens RAB9A, member RAS oncogene family Starlite/ChEMBL No references
Photinus pyralis Luciferin 4-monooxygenase Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 2, subfamily C, polypeptide 19 Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 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 9 Starlite/ChEMBL No references
Homo sapiens breast cancer 1, early onset Starlite/ChEMBL No references
Homo sapiens Niemann-Pick disease, type C1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania mexicana 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Echinococcus multilocularis Niemann Pick C1 protein Get druggable targets OG5_128206 All targets in OG5_128206
Loa Loa (eye worm) hypothetical 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
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii peroxisomal-coenzyme a synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Niemann-Pick C1 protein precursor, putative Get druggable targets OG5_128206 All targets in OG5_128206
Echinococcus granulosus Niemann Pick C1 protein Get druggable targets OG5_128206 All targets in OG5_128206
Entamoeba histolytica acyl-CoA synthetase, putative Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) Get druggable targets OG5_126609 All targets in OG5_126609
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani 4-coumarate:coa ligase-like protein 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
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Echinococcus granulosus Niemann Pick C1 protein Get druggable targets OG5_128206 All targets in OG5_128206
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum 4-coumarate:coa ligase-like 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
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
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
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium knowlesi acyl-CoA synthetase, putative 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
Leishmania major 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128206 All targets in OG5_128206
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans acyl-CoA synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Echinococcus multilocularis Niemann Pick C1 protein Get druggable targets OG5_128206 All targets in OG5_128206
Plasmodium falciparum acyl-CoA synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni niemann-pick C1 (NPC1) Get druggable targets OG5_128206 All targets in OG5_128206
Leishmania mexicana 4-coumarate:coa ligase-like protein 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 ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
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
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans fatty-acid-CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Onchocerca volvulus Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma japonicum Niemann-Pick C1 protein precursor, putative Get druggable targets OG5_128206 All targets in OG5_128206
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Echinococcus granulosus expressed conserved protein Get druggable targets OG5_128206 All targets in OG5_128206
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
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
Leishmania mexicana 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Mycobacterium ulcerans hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
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
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126609 All targets in OG5_126609
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium vivax acyl-CoA synthetase, putative 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
Mycobacterium ulcerans acyl-CoA synthetase Get druggable targets OG5_126609 All targets in OG5_126609
Schistosoma japonicum ko:K07003 Niemann Pick type C1, putative Get druggable targets OG5_128206 All targets in OG5_128206
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei acyl-CoA synthetase, putative 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
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128206 All targets in OG5_128206
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi AMP-binding enzyme family 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
Mycobacterium ulcerans long-chain fatty-acid CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein 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
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
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica Niemann-Pick C1 protein, putative Get druggable targets OG5_128206 All targets in OG5_128206
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
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
Brugia malayi AMP-binding enzyme family protein Get druggable targets OG5_126609 All targets in OG5_126609
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase Get druggable targets OG5_126609 All targets in OG5_126609
Brugia malayi Niemann-Pick C1 protein precursor Get druggable targets OG5_128206 All targets in OG5_128206
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans potential membrane protein similar to S. cerevisiae NCR1 (YPL006W) and human NPC1 late endosomal protein involved in sterol home Get druggable targets OG5_128206 All targets in OG5_128206
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi AMP-binding enzyme family protein Get druggable targets OG5_126609 All targets in OG5_126609
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase Get druggable targets OG5_126609 All targets in OG5_126609
Echinococcus multilocularis expressed conserved protein Get druggable targets OG5_128206 All targets in OG5_128206
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major 4-coumarate:coa ligase-like protein Get druggable targets OG5_126609 All targets in OG5_126609
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica acyl-CoA synthetase, putative 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
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni FAA1 Long-chain-fatty-acid--CoA ligase 1 Luciferin 4-monooxygenase   550 aa 494 aa 26.3 %
Leishmania donovani long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 500 aa 23.4 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 494 aa 24.3 %
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 %
Trichomonas vaginalis AMP dependent CoA ligase, putative Luciferin 4-monooxygenase   550 aa 527 aa 25.0 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 593 aa 22.1 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 539 aa 19.1 %
Dictyostelium discoideum AMP-dependent synthetase and ligase domain-containing protein Luciferin 4-monooxygenase   550 aa 545 aa 24.9 %
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD29 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 617 aa 22.2 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 499 aa 19.2 %
Trichomonas vaginalis AMP dependent ligase, putative Luciferin 4-monooxygenase   550 aa 445 aa 26.1 %
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 %
Dictyostelium discoideum acetyl-CoA ligase Luciferin 4-monooxygenase   550 aa 549 aa 22.2 %
Theileria parva long-chain fatty acid CoA ligase, putative Luciferin 4-monooxygenase   550 aa 507 aa 23.5 %
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 Luciferin 4-monooxygenase   550 aa 493 aa 22.1 %
Schistosoma japonicum ko:K08745 solute carrier family 27 (fatty acid transporter), member 1, putative Luciferin 4-monooxygenase   550 aa 501 aa 24.6 %
Cryptosporidium hominis acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 460 aa 26.1 %
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 541 aa 21.6 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 554 aa 24.4 %
Entamoeba histolytica acyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 446 aa 22.0 %
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 543 aa 24.5 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 538 aa 21.8 %
Trichomonas vaginalis long-chain-fatty-acid CoA ligase, putative Luciferin 4-monooxygenase   550 aa 466 aa 21.7 %
Echinococcus multilocularis long chain fatty acid coenzyme A ligase 5 Luciferin 4-monooxygenase   550 aa 458 aa 25.5 %
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 %
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase FadD15 Luciferin 4-monooxygenase   550 aa 482 aa 24.3 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 497 aa 19.3 %
Trichomonas vaginalis AMP dependent CoA ligase, putative Luciferin 4-monooxygenase   550 aa 492 aa 23.6 %
Trypanosoma brucei gambiense fatty acyl CoA synthetase 3 Luciferin 4-monooxygenase   550 aa 491 aa 23.6 %
Leishmania braziliensis acetyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 603 aa 22.6 %
Trichomonas vaginalis antibiotic synthetase, putative Luciferin 4-monooxygenase   550 aa 581 aa 21.2 %
Mycobacterium ulcerans non-ribosomal peptide synthetase Luciferin 4-monooxygenase   550 aa 541 aa 22.4 %
Echinococcus granulosus long chain fatty acid coenzyme A ligase 1 Luciferin 4-monooxygenase   550 aa 452 aa 26.1 %
Mycobacterium ulcerans putative fatty-acid--CoA ligase Luciferin 4-monooxygenase   550 aa 576 aa 20.8 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 558 aa 20.4 %
Babesia bovis long-chain acyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 445 aa 21.8 %
Leishmania braziliensis long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 496 aa 22.8 %
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 541 aa 21.6 %
Trypanosoma cruzi fatty acyl CoA synthetase 2, putative Luciferin 4-monooxygenase   550 aa 495 aa 22.6 %
Dictyostelium discoideum fatty acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 462 aa 23.8 %
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 %
Leishmania mexicana long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 483 aa 23.8 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 542 aa 18.3 %
Loa Loa (eye worm) AMP-binding enzyme family protein Luciferin 4-monooxygenase   550 aa 489 aa 23.3 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 478 aa 21.1 %
Neospora caninum acetyl-coenzyme a synthetase, putative Luciferin 4-monooxygenase   550 aa 549 aa 20.9 %
Schistosoma japonicum ko:K01897 long-chain fatty-acid-CoA ligase [EC6.2.1.3], putative Luciferin 4-monooxygenase   550 aa 541 aa 22.4 %
Schistosoma japonicum ko:K01897 long-chain fatty-acid-CoA ligase [EC6.2.1.3], putative Luciferin 4-monooxygenase   550 aa 466 aa 27.3 %
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD28 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 504 aa 22.6 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 576 aa 19.8 %
Mycobacterium ulcerans fatty-acid-CoA ligase FadD11 Luciferin 4-monooxygenase   550 aa 498 aa 23.5 %
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 541 aa 21.4 %
Dictyostelium discoideum AMP-dependent synthetase and ligase domain-containing protein Luciferin 4-monooxygenase   550 aa 517 aa 24.8 %
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 %
Trichomonas vaginalis antibiotic synthetase, putative Luciferin 4-monooxygenase   550 aa 577 aa 22.2 %
Brugia malayi AMP-binding enzyme family protein Luciferin 4-monooxygenase   550 aa 544 aa 21.5 %
Trypanosoma cruzi fatty acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 482 aa 24.7 %
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 %
Leishmania braziliensis long-chain-fatty-acid-CoA ligase, putative Luciferin 4-monooxygenase   550 aa 504 aa 25.6 %
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 %
Echinococcus granulosus long chain fatty acid coenzyme A ligase 5 Luciferin 4-monooxygenase   550 aa 458 aa 25.8 %
Mycobacterium leprae FATTY-ACID-CoA LIGASE FADD26 (FATTY-ACID-COA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) Luciferin 4-monooxygenase   550 aa 533 aa 22.7 %
Cryptosporidium parvum acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 460 aa 25.7 %
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 cytochrome P450, family 2, subfamily C, polypeptide 9 490 aa 441 aa 21.8 %
Echinococcus multilocularis long chain fatty acid coenzyme A ligase 1 Luciferin 4-monooxygenase   550 aa 459 aa 27.0 %
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) Luciferin 4-monooxygenase   550 aa 509 aa 22.6 %
Echinococcus granulosus 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 %
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein Luciferin 4-monooxygenase   550 aa 476 aa 22.5 %
Dictyostelium discoideum fatty acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 501 aa 24.4 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 539 aa 19.1 %
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative Luciferin 4-monooxygenase   550 aa 476 aa 20.8 %
Mycobacterium tuberculosis Probable acyl-CoA ligase FadD31 (acyl-CoA synthetase) (acyl-CoA synthase) Luciferin 4-monooxygenase   550 aa 592 aa 20.4 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 522 aa 19.9 %
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 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 526 aa 22.4 %
Leishmania mexicana acetyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 559 aa 20.6 %
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase FadD15 Luciferin 4-monooxygenase   550 aa 484 aa 26.0 %
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative Luciferin 4-monooxygenase   550 aa 480 aa 21.5 %
Trypanosoma brucei gambiense fatty acyl CoA synthetase 4, putative Luciferin 4-monooxygenase   550 aa 497 aa 23.7 %
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 1 Luciferin 4-monooxygenase   550 aa 443 aa 26.4 %
Dictyostelium discoideum AMP-dependent synthetase and ligase domain-containing protein Luciferin 4-monooxygenase   550 aa 550 aa 20.9 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 535 aa 21.7 %
Mycobacterium ulcerans fatty-acid-CoA ligase FadD9 Luciferin 4-monooxygenase   550 aa 463 aa 21.8 %
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE Luciferin 4-monooxygenase   550 aa 502 aa 22.5 %
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 %
Trichomonas vaginalis long-chain-fatty-acid CoA ligase, putative Luciferin 4-monooxygenase   550 aa 490 aa 23.3 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 554 aa 22.9 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 542 aa 22.1 %
Leishmania braziliensis acetyl-CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 596 aa 21.1 %
Toxoplasma gondii propionate-CoA ligase Luciferin 4-monooxygenase   550 aa 550 aa 21.1 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 541 aa 21.4 %
Trypanosoma congolense fatty acyl CoA synthetase 2, putative Luciferin 4-monooxygenase   550 aa 500 aa 22.4 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 522 aa 19.9 %
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 %
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 transport protein 4 Luciferin 4-monooxygenase   550 aa 476 aa 22.3 %
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 %
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative Luciferin 4-monooxygenase   550 aa 494 aa 23.9 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 542 aa 18.3 %
Trichomonas vaginalis AMP dependent ligase/synthetase, putative Luciferin 4-monooxygenase   550 aa 476 aa 23.5 %
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD26 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) Luciferin 4-monooxygenase   550 aa 560 aa 21.4 %
Trypanosoma brucei fatty acyl CoA synthetase 3 Luciferin 4-monooxygenase   550 aa 491 aa 23.6 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 582 aa 22.3 %
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 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 538 aa 21.8 %
Cryptosporidium parvum acetyl-coenzyme A synthetase Luciferin 4-monooxygenase   550 aa 545 aa 22.8 %
Candida albicans similar to S. cerevisiae FAA4 (YMR246W) long-chain fatty acid--CoA synthetase Luciferin 4-monooxygenase   550 aa 478 aa 23.4 %
Onchocerca volvulus Luciferin 4-monooxygenase   550 aa 487 aa 23.8 %
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 %
Cryptosporidium parvum putative long chain fatty acyl CoA synthetase having a signal peptide Luciferin 4-monooxygenase   550 aa 472 aa 24.8 %
Leishmania major long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 482 aa 23.2 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 542 aa 22.1 %
Cryptosporidium hominis acetyl-CoenzymeA synthetase (acetate--coa ligase) (acyl-activating enzyme) Luciferin 4-monooxygenase   550 aa 549 aa 22.6 %
Trichomonas vaginalis AMP dependent CoA ligase, putative Luciferin 4-monooxygenase   550 aa 524 aa 24.0 %
Dictyostelium discoideum AMP-dependent synthetase and ligase domain-containing protein Luciferin 4-monooxygenase   550 aa 531 aa 19.0 %
Trypanosoma cruzi fatty acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 480 aa 25.2 %
Leishmania infantum long chain fatty Acyl CoA synthetase, putative Luciferin 4-monooxygenase   550 aa 500 aa 23.4 %
Plasmodium falciparum ras-related protein Rab-5B RAB9A, member RAS oncogene family 201 aa 165 aa 30.9 %
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF Luciferin 4-monooxygenase   550 aa 558 aa 20.1 %
Mycobacterium ulcerans acyl-CoA synthetase Luciferin 4-monooxygenase   550 aa 601 aa 22.5 %
Brugia malayi Cytochrome P450 family protein cytochrome P450, family 1, subfamily A, polypeptide 2 516 aa 470 aa 26.2 %
Dictyostelium discoideum hypothetical protein Luciferin 4-monooxygenase   550 aa 507 aa 20.9 %
Brugia malayi AMP-binding enzyme family protein Luciferin 4-monooxygenase   550 aa 497 aa 24.7 %
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 leprae Probable fatty-acid-CoA synthetase FadD29 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) Luciferin 4-monooxygenase   550 aa 529 aa 22.3 %
Onchocerca volvulus Luciferin 4-monooxygenase   550 aa 502 aa 24.9 %
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase Luciferin 4-monooxygenase   550 aa 509 aa 21.8 %
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 %
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 %
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase, FadD11 Luciferin 4-monooxygenase   550 aa 492 aa 24.6 %
Onchocerca volvulus Lysine-specific histone demethylase 1A homolog Luciferin 4-monooxygenase   550 aa 550 aa 22.5 %
Neospora caninum Short-chain dehydrogenase/reductase SDR, related Luciferin 4-monooxygenase   550 aa 518 aa 19.1 %
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 %
Leishmania major cytochrome p450-like protein cytochrome P450, family 2, subfamily C, polypeptide 19 490 aa 411 aa 23.1 %
Toxoplasma gondii type I fatty acid synthase, putative Luciferin 4-monooxygenase   550 aa 514 aa 19.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni serine/threonine-protein kinase 0.0062 0.0165 0.0517
Trichomonas vaginalis cAMP-dependent protein kinase catalytic subunit, putative 0.0047 0.0114 0.2482
Brugia malayi p70 ribosomal S6 kinase beta 0.0122 0.037 0.0342
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Schistosoma mansoni serine/threonine protein kinase 0.0064 0.0169 0.053
Echinococcus multilocularis Glutaredoxin protein 5 0.0059 0.0152 0.0375
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0064 0.0169 0.0427
Schistosoma mansoni hypothetical protein 0.0049 0.012 0.0375
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0029 0.5
Brugia malayi Hr1 repeat family protein 0.0064 0.0169 0.014
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.01 0.0217
Entamoeba histolytica PH domain containing protein kinase, putative 0.0062 0.0165 0.0504
Entamoeba histolytica hypothetical protein 0.0043 0.01 0.0263
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Echinococcus multilocularis serine:threonine protein kinase N2 0.0064 0.0169 0.0427
Trichomonas vaginalis AGC family protein kinase 0.0122 0.037 1
Brugia malayi hypothetical protein 0.0043 0.01 0.0071
Entamoeba histolytica protein kinase, putative 0.0122 0.037 0.1263
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0029 0.0005
Echinococcus multilocularis serine threonine protein kinase 0.0064 0.0169 0.0427
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0049 0.002
Leishmania major 4-coumarate:coa ligase-like protein 0.0029 0.0049 1
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Schistosoma mansoni hypothetical protein 0.0043 0.01 0.0313
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0083 0.0235 0.063
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0059 0.0152 0.0389
Schistosoma mansoni atypical protein kinase C 0.0064 0.0169 0.053
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0064 0.0169 0.0427
Echinococcus multilocularis rac serine:threonine kinase 0.0062 0.0165 0.0415
Echinococcus granulosus protein kinase c iota type 0.0064 0.0169 0.0443
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Loa Loa (eye worm) AGC/PKG protein kinase 0.0083 0.0235 0.0211
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.0029 0.2958
Entamoeba histolytica PH domain containing protein kinase, putative 0.0062 0.0165 0.0504
Trichomonas vaginalis AGC family protein kinase 0.0064 0.0169 0.4109
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0049 0.1252
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0107 0.0318 0.0295
Trichomonas vaginalis AGC family protein kinase 0.0107 0.0318 0.8492
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Echinococcus granulosus Niemann Pick C1 protein 0.017 0.0533 0.1595
Trichomonas vaginalis ribosomal protein S6 kinase, 90kD, polypeptide, putative 0.0047 0.0114 0.2482
Trichomonas vaginalis AGC family protein kinase 0.0122 0.037 1
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Entamoeba histolytica protein kinase, putative 0.0122 0.037 0.1263
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0064 0.0169 0.0145
Loa Loa (eye worm) hypothetical protein 0.0051 0.0126 0.0102
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0029 0.5
Schistosoma mansoni ap endonuclease 0.0023 0.0029 0.0091
Trichomonas vaginalis AGC family protein kinase 0.0122 0.037 1
Echinococcus multilocularis serine:threonine protein kinase N2 0.0064 0.0169 0.0427
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0059 0.0152 0.0375
Entamoeba histolytica protein kinase, putative 0.0122 0.037 0.1263
Trichomonas vaginalis conserved hypothetical protein 0.0051 0.0126 0.2846
Echinococcus granulosus cGMP dependent protein kinase 1 0.0083 0.0235 0.0653
Echinococcus granulosus nervana 2 0.0059 0.0152 0.0389
Schistosoma mansoni serine/threonine protein kinase 0.0083 0.0235 0.0738
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Schistosoma mansoni serine/threonine protein kinase 0.0064 0.0169 0.053
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.01 0.0225
Echinococcus multilocularis Niemann Pick C1 protein 0.017 0.0533 0.1539
Plasmodium vivax rac-beta serine/threonine protein kinase, putative 0.0062 0.0165 1
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0049 1
Echinococcus multilocularis rho associated protein kinase 0.0946 0.319 0.9649
Entamoeba histolytica hypothetical protein 0.081 0.2726 1
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0062 0.0165 1
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Schistosoma mansoni serine/threonine kinase 0.0064 0.0169 0.053
Schistosoma mansoni hypothetical protein 0.0049 0.012 0.0375
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Onchocerca volvulus 0.0942 0.3177 0.9959
Echinococcus granulosus Glutaredoxin protein 5 0.0059 0.0152 0.0389
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Brugia malayi protein kinase C II. 0.0064 0.0169 0.014
Echinococcus multilocularis expressed conserved protein 0.0112 0.0334 0.093
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0122 0.037 0.0346
Echinococcus granulosus serine:threonine protein kinase N2 0.0064 0.0169 0.0443
Loa Loa (eye worm) hypothetical protein 0.0029 0.0049 0.0025
Onchocerca volvulus 0.0946 0.319 1
Echinococcus granulosus serine/threonine protein kinase 0.0062 0.0165 0.043
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0064 0.0169 0.0427
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0119 0.0358 0.1221
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0049 0.002
Schistosoma mansoni ap endonuclease 0.0023 0.0029 0.0091
Echinococcus multilocularis serine threonine protein kinase nrc serine threonine protein kinase gad 0.0062 0.0165 0.0415
Schistosoma mansoni serine/threonine protein kinase 0.0064 0.0169 0.053
Plasmodium falciparum cGMP-dependent protein kinase 0.0083 0.0235 1
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0064 0.0169 0.0443
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0029 0.0049 0.5
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Toxoplasma gondii protein kinase G AGC kinase family member PKG 0.0083 0.0235 0.6061
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Loa Loa (eye worm) AGC/PKN protein kinase 0.0064 0.0169 0.0145
Loa Loa (eye worm) cytochrome P450 family protein 0.0059 0.0153 0.0129
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0029 0.0049 0.5
Loa Loa (eye worm) AGC/NDR protein kinase 0.0064 0.0169 0.0145
Entamoeba histolytica protein kinase 2, putative 0.0062 0.0165 0.0504
Trichomonas vaginalis AGC family protein kinase 0.0122 0.037 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0029 0.0049 0.1252
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0083 0.0235 0.063
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0029 0.0049 1
Trichomonas vaginalis serine/threonine-protein kinase sgk, putative 0.0103 0.0305 0.811
Brugia malayi Protein kinase domain containing protein 0.0107 0.0318 0.029
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0029 0.0049 0.1252
Mycobacterium ulcerans hypothetical protein 0.0079 0.0222 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0049 0.0025
Echinococcus granulosus Protein kinase C brain isozyme 0.0064 0.0169 0.0443
Mycobacterium ulcerans hypothetical protein 0.0029 0.0049 0.1252
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0029 0.0214
Echinococcus granulosus NDR protein kinase 0.0064 0.0169 0.0443
Echinococcus granulosus serine threonine protein kinase nrc 0.0062 0.0165 0.043
Schistosoma mansoni serine/threonine protein kinase 0.0064 0.0169 0.053
Echinococcus multilocularis sterol regulatory element binding protein 0.0051 0.0126 0.0296
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Loa Loa (eye worm) hypothetical protein 0.0062 0.0165 0.0141
Schistosoma mansoni serine/threonine protein kinase 0.0064 0.0169 0.053
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0062 0.0165 1
Echinococcus multilocularis expressed conserved protein 0.0083 0.0235 0.063
Trypanosoma cruzi Protein kinase B 0.0062 0.0165 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.0358 0.0335
Schistosoma mansoni serine/threonine protein kinase 0.0064 0.0169 0.053
Echinococcus multilocularis protein dispatched 1 0.0058 0.0151 0.0371
Echinococcus multilocularis protein patched 0.0051 0.0126 0.0296
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0021 0.0024 0.139
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0029 0.0322
Echinococcus multilocularis Niemann Pick C1 protein 0.0119 0.0358 0.1006
Entamoeba histolytica hypothetical protein 0.0043 0.01 0.0263
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0049 0.1252
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0121 0.0365 0.1143
Brugia malayi CHE-14 protein 0.0051 0.0126 0.0097
Brugia malayi Protein kinase domain containing protein 0.0064 0.0169 0.014
Entamoeba histolytica acyl-coA synthetase, putative 0.0029 0.0049 0.0075
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Echinococcus multilocularis nervana 2 0.0059 0.0152 0.0375
Schistosoma mansoni serine/threonine protein kinase 0.0083 0.0235 0.0738
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0064 0.0169 0.0145
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0029 0.0228
Entamoeba histolytica hypothetical protein 0.0043 0.01 0.0263
Schistosoma mansoni hypothetical protein 0.0049 0.012 0.0375
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0051 0.0126 0.0102
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0064 0.0169 0.0145
Echinococcus granulosus protein kinase C gamma type 0.0064 0.0169 0.0443
Trichomonas vaginalis AGC family protein kinase 0.0122 0.037 1
Echinococcus granulosus expressed conserved protein 0.0112 0.0334 0.0964
Schistosoma mansoni serine/threonine-protein kinase 0.0062 0.0165 0.0517
Brugia malayi Niemann-Pick C1 protein precursor 0.0119 0.0358 0.033
Entamoeba histolytica protein kinase, putative 0.0064 0.0169 0.0519
Schistosoma mansoni serine/threonine protein kinase 0.0064 0.0169 0.053
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Plasmodium falciparum RAC-beta serine/threonine protein kinase 0.0062 0.0165 0.6656
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0049 0.1252
Entamoeba histolytica acyl-CoA synthetase, putative 0.0029 0.0049 0.0075
Echinococcus multilocularis nervana 2 0.0059 0.0152 0.0375
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0021 0.0024 0.5
Trichomonas vaginalis AGC family protein kinase 0.0122 0.037 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0049 0.0025
Brugia malayi Egg laying defective protein 4 0.0083 0.0235 0.0207
Trichomonas vaginalis AGC family protein kinase 0.0107 0.0318 0.8492
Schistosoma mansoni hypothetical protein 0.0049 0.012 0.0375
Trichomonas vaginalis serine/threonine-protein kinase ypk, putative 0.0047 0.0114 0.2482
Echinococcus granulosus cGMP dependent protein kinase 1 0.0083 0.0235 0.0653
Giardia lamblia Kinase, AGC PKA 0.0062 0.0165 1
Loa Loa (eye worm) AGC/AKT protein kinase 0.0122 0.037 0.0346
Entamoeba histolytica hypothetical protein 0.0043 0.01 0.0263
Brugia malayi Cytochrome P450 family protein 0.0059 0.0153 0.0124
Echinococcus granulosus calcium:calmodulin dependent protein kinase 0.0062 0.0165 0.043
Toxoplasma gondii AGC kinase 0.0122 0.037 1
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Trichomonas vaginalis serine/threonine-protein kinase, putative 0.0047 0.0114 0.2482
Schistosoma mansoni serine/threonine protein kinase 0.0946 0.319 1
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Echinococcus granulosus rho-associated protein kinase 1 0.0946 0.319 1
Entamoeba histolytica acyl-CoA synthetase, putative 0.0029 0.0049 0.0075
Loa Loa (eye worm) AGC/DMPK/ROCK protein kinase 0.2934 1 1
Echinococcus granulosus protein kinase c epsilon type 0.0064 0.0169 0.0443
Trichomonas vaginalis 3-phosphoinositide dependent protein kinase-1, putative 0.0047 0.0114 0.2482
Echinococcus multilocularis serine:threonine protein kinase 38 0.0064 0.0169 0.0427
Trypanosoma brucei rac serine-threonine kinase, putative 0.0122 0.037 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.3305 1
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0029 0.0049 0.1252
Trichomonas vaginalis AGC family protein kinase 0.0122 0.037 1
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Schistosoma mansoni patched 1 0.0051 0.0126 0.0395
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0029 0.5884
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.01 0.0313
Echinococcus granulosus Niemann Pick C1 protein 0.0119 0.0358 0.1042
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0029 0.0049 0.1252
Trichomonas vaginalis AGC family protein kinase 0.0107 0.0318 0.8492
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Echinococcus multilocularis protein kinase c iota type 0.0064 0.0169 0.0427
Loa Loa (eye worm) hypothetical protein 0.0064 0.0169 0.0145
Echinococcus granulosus nervana 2 0.0059 0.0152 0.0389
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0064 0.0169 0.0443
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0064 0.0169 0.0427
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Trichomonas vaginalis AGC family protein kinase 0.0047 0.0114 0.2482
Brugia malayi AMP-binding enzyme family protein 0.0029 0.0049 0.002
Echinococcus granulosus sterol regulatory element binding protein 0.0051 0.0126 0.0307
Brugia malayi Protein kinase domain containing protein 0.0122 0.037 0.0342
Echinococcus multilocularis protein kinase c epsilon type 0.0064 0.0169 0.0427
Echinococcus granulosus cGMP dependent protein kinase 0.0083 0.0235 0.0653
Leishmania major 4-coumarate:coa ligase-like protein 0.0029 0.0049 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0029 0.0049 1
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0064 0.0169 0.0443
Echinococcus granulosus Protein patched homolog 1 0.0051 0.0126 0.0307

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) = 2.238721139 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) = 4.466835922 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) = 7.943282347 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) = 28.18382931 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
Potency (functional) 0.02 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 2.2387 um PUBCHEM_BIOASSAY: qHTS Assay for Rab9 Promoter Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.1623 um PUBCHEM_BIOASSAY: qHTS Assay for NPC1 Promoter Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 4.1095 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 10.4179 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) 12.5893 uM PubChem BioAssay. qHTS Assay to Identify Small Molecule Activators of BRCA1 Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 13.1154 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 14.581 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143] ChEMBL. No reference
Potency (functional) 16.9441 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) 18.3564 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (binding) 28.1838 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum 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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