Detailed information for compound 2188865

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 697.201 | Formula: C34H35NO15
  • H donors: 6 H acceptors: 10 LogP: 1.04 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 2
  • SMILES: CO[C@@H]1C(O[C@@H]([C@H]([C@@H]1O)OC)C)NC1=CC(=O)c2c(C1=O)cc1c(c2O)C(=O)[C@]2([C@@](C1=O)(O)c1c(C[C@H]2O)cc(c(c1O)C(=O)OC)C)OC
  • InChi: InChI=1S/C34H35NO15/c1-11-7-13-8-18(37)34(49-6)30(43)21-15(29(42)33(34,45)22(13)25(40)19(11)32(44)48-5)9-14-20(24(21)39)17(36)10-16(23(14)38)35-31-28(47-4)26(41)27(46-3)12(2)50-31/h7,9-10,12,18,26-28,31,35,37,39-41,45H,8H2,1-6H3/t12-,18-,26+,27-,28+,31?,33-,34-/m1/s1
  • InChiKey: QAXIGMXDHAMYPV-VDHVXQHASA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus tar DNA binding protein 0.013 0.2669 0.2669
Trichomonas vaginalis esterase, putative 0.0036 0.0628 0.1069
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0022 0.0321 0.2741
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.006 0.1153 0.133
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0144 0.2968 0.5098
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0009 0.0047 0.0047
Trichomonas vaginalis glucosylceramidase, putative 0.0275 0.5816 1
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0022 0.0321 0.5056
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0628 0.1069
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0022 0.0321 0.0649
Brugia malayi Calcitonin receptor-like protein seb-1 0.0155 0.3212 0.5518
Echinococcus granulosus smad 0.0008 0.0027 0.0027
Mycobacterium ulcerans beta-lactamase 0.0036 0.0628 0.5421
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0045 0.0817 0.1395
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.2968 0.3424
Schistosoma mansoni cytochrome P450 0.0022 0.0321 0.037
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0035 0.0049
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0394 0.0666
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0265 0.0445
Trypanosoma brucei unspecified product 0.0013 0.0135 0.2064
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.0394 0.6232
Echinococcus multilocularis dnaJ subfamily B 0.0406 0.8668 0.8668
Trichomonas vaginalis glucosylceramidase, putative 0.0275 0.5816 1
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.0394 0.1683
Trichomonas vaginalis glucosylceramidase, putative 0.0275 0.5816 1
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.0628 0.1285
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0155 0.3212 0.5518
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.3763 0.6466
Onchocerca volvulus 0.0029 0.0466 0.1221
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0009 0.0047 0.0047
Brugia malayi CXXC zinc finger family protein 0.0029 0.0466 0.0789
Schistosoma mansoni hypothetical protein 0.0022 0.0321 0.037
Leishmania major cytochrome p450-like protein 0.0022 0.0321 0.2741
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0628 0.1069
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0233 0.0468
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0022 0.0321 0.0649
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0394 0.3378
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0144 0.2968 0.2968
Echinococcus granulosus protocadherin 11 0.0009 0.0047 0.0047
Entamoeba histolytica hypothetical protein 0.0113 0.2307 1
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0022 0.0321 0.2741
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0027 0.0034
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0265 0.2254
Loa Loa (eye worm) hypothetical protein 0.0036 0.0628 0.1069
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0135 0.2064
Echinococcus granulosus ccaat enhancer binding protein delta 0.0009 0.0047 0.0047
Toxoplasma gondii histone lysine methyltransferase SET1 0.0058 0.1101 1
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0022 0.0321 0.2741
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0265 0.0534
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.3974 0.6829
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0394 0.3378
Schistosoma mansoni hypothetical protein 0.017 0.3527 0.4069
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0022 0.0321 0.2741
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0135 0.2064
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0009 0.0047 0.0047
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Echinococcus multilocularis GPCR, family 2 0.0049 0.0911 0.0911
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0009 0.0047 0.0047
Schistosoma mansoni hypothetical protein 0.0049 0.0911 0.1051
Loa Loa (eye worm) Smad1 0.0008 0.0027 0.0034
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Brugia malayi Latrophilin receptor protein 2 0.0049 0.0911 0.1556
Brugia malayi hypothetical protein 0.0151 0.3129 0.5374
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0022 0.0321 0.2741
Loa Loa (eye worm) hypothetical protein 0.0019 0.0256 0.0428
Mycobacterium leprae Conserved hypothetical protein 0.0022 0.0321 0.5056
Onchocerca volvulus 0.0036 0.0628 0.1654
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0155 0.3212 0.5518
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0628 0.0725
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0022 0.0321 0.2741
Entamoeba histolytica deoxycytidyl transferase, putative 0.0019 0.0265 0.1123
Schistosoma mansoni tar DNA-binding protein 0.013 0.2669 0.3079
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0394 0.3378
Giardia lamblia Histone acetyltransferase GCN5 0.0041 0.0736 1
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0045 0.0817 1
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0022 0.0321 0.0649
Brugia malayi Cell death specification protein 2 0.0009 0.0047 0.0068
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0049 0.0911 0.1556
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0628 0.0628
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0394 0.0666
Schistosoma mansoni hypothetical protein 0.0009 0.0047 0.0054
Loa Loa (eye worm) CYP4Cod1 0.0022 0.0321 0.0541
Echinococcus multilocularis protocadherin 11 0.0009 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0019 0.0256 0.0428
Echinococcus granulosus dna polymerase eta 0.0019 0.0265 0.0265
Loa Loa (eye worm) hypothetical protein 0.0009 0.0047 0.0068
Echinococcus multilocularis dna polymerase eta 0.0019 0.0265 0.0265
Plasmodium vivax acyl-CoA synthetase, putative 0.0019 0.0256 0.3068
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.006 0.1153 1
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0022 0.0321 0.2741
Echinococcus multilocularis tar DNA binding protein 0.013 0.2669 0.2669
Loa Loa (eye worm) hypothetical protein 0.0019 0.0256 0.0428
Entamoeba histolytica hypothetical protein 0.0113 0.2307 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0019 0.0256 0.2169
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0027 0.0031
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0265 0.0306
Loa Loa (eye worm) TAR-binding protein 0.013 0.2669 0.4583
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0265 0.4158
Schistosoma mansoni hypothetical protein 0.017 0.3527 0.4069
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0394 0.3378
Trichomonas vaginalis glucosylceramidase, putative 0.0275 0.5816 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0041 0.0736 0.317
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0007 0.0007 0.0007
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0056 0.1065 0.1821
Echinococcus multilocularis survival motor neuron protein 1 0.0236 0.4977 0.4977
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0049 0.0911 0.0911
Schistosoma mansoni DNA polymerase eta 0.0019 0.0265 0.0306
Leishmania major DNA polymerase kappa, putative 0.0019 0.0265 0.2254
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0394 0.3378
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0027 0.0034
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0022 0.0321 0.0649
Brugia malayi MH2 domain containing protein 0.0008 0.0027 0.0034
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0628 1
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0022 0.0321 0.0649
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.0265 0.4158
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0022 0.0321 0.2741
Mycobacterium tuberculosis Possible penicillin-binding protein 0.023 0.4843 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0047 0.0068
Onchocerca volvulus 0.0011 0.0095 0.0234
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0022 0.0321 0.2741
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0265 0.4158
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0038 0.0038
Trypanosoma brucei unspecified product 0.0013 0.0135 0.2064
Brugia malayi Armadillo/beta-catenin-like repeat family protein 0.0116 0.2355 0.4042
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0265 0.0265
Onchocerca volvulus 0.0009 0.0047 0.0105
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0275 0.5816 1
Echinococcus multilocularis 0.0022 0.0321 0.0321
Schistosoma mansoni cpg binding protein 0.003 0.0501 0.0578
Loa Loa (eye worm) hypothetical protein 0.0025 0.0394 0.0666
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0628 0.0628
Onchocerca volvulus 0.0151 0.3129 0.8311
Brugia malayi MH1 domain containing protein 0.0008 0.0027 0.0034
Schistosoma mansoni tar DNA-binding protein 0.013 0.2669 0.3079
Loa Loa (eye worm) cell death specification protein 2 0.0009 0.0047 0.0068
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0394 0.3378
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0113 0.2307 0.2307
Echinococcus granulosus neuropeptide receptor A26 0.0468 1 1
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0022 0.0321 0.2741
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0144 0.2968 0.2968
Entamoeba histolytica hypothetical protein 0.0009 0.0047 0.0172
Schistosoma mansoni smad 0.0008 0.0027 0.0031
Loa Loa (eye worm) hypothetical protein 0.0009 0.0047 0.0068
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.2968 0.3424
Onchocerca volvulus 0.0036 0.0628 0.1654
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0144 0.2968 0.5098
Echinococcus multilocularis beta catenin 0.0116 0.2355 0.2355
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Schistosoma mansoni hypothetical protein 0.0048 0.0893 0.103
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0113 0.2307 0.2307
Echinococcus multilocularis cyclic AMP responsive element binding protein 0.0009 0.0047 0.0047
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0022 0.0321 0.0649
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0022 0.0321 0.2741
Loa Loa (eye worm) hypothetical protein 0.0049 0.0911 0.1556
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0019 0.0256 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.006 0.1153 1
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0022 0.0321 0.0649
Loa Loa (eye worm) hypothetical protein 0.0036 0.0628 0.1069
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0394 0.3378
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.006 0.1153 0.237
Brugia malayi hypothetical protein 0.0009 0.0047 0.0068
Loa Loa (eye worm) latrophilin receptor protein 2 0.0049 0.0911 0.1556
Loa Loa (eye worm) hypothetical protein 0.0036 0.0628 0.1069
Schistosoma mansoni cpg binding protein 0.0029 0.0466 0.0537
Brugia malayi Cytochrome P450 family protein 0.0022 0.0321 0.0541
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Loa Loa (eye worm) hypothetical protein 0.0019 0.0256 0.0428
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0628 0.7668
Schistosoma mansoni acetyl-CoA synthetase 0.0007 0.0007 0.0008
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0265 0.0265
Onchocerca volvulus 0.0025 0.0394 0.1031
Loa Loa (eye worm) hypothetical protein 0.0036 0.0628 0.1069
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0036 0.0628 0.5421
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Brugia malayi latrophilin 2 splice variant baaae 0.0106 0.2147 0.3684
Echinococcus multilocularis tumor protein p63 0.0354 0.7544 0.7544
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0233 0.0468
Echinococcus multilocularis X box binding protein 1 0.0291 0.6172 0.6172
Loa Loa (eye worm) acetyltransferase 0.0152 0.3148 0.5407
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0022 0.0321 0.0649
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0027 0.0027
Toxoplasma gondii cytochrome p450 superfamily protein 0.0022 0.0321 0.2872
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0022 0.0321 0.2741
Brugia malayi hypothetical protein 0.0009 0.0047 0.0068
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0022 0.0321 0.2741
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0022 0.0321 0.2741
Schistosoma mansoni tar DNA-binding protein 0.013 0.2669 0.3079
Brugia malayi acetyltransferase, GNAT family protein 0.0152 0.3148 0.5407
Onchocerca volvulus 0.0009 0.0047 0.0105
Loa Loa (eye worm) bZIP transcription factor family protein 0.0009 0.0047 0.0068
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.006 0.1153 0.1153
Echinococcus granulosus beta catenin 0.0116 0.2355 0.2355
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.0628 1
Trichomonas vaginalis bromodomain-containing protein, putative 0.0045 0.0817 0.1395
Echinococcus multilocularis neuropeptide s receptor 0.0468 1 1
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0628 1
Brugia malayi RNA recognition motif domain containing protein 0.013 0.2669 0.4583
Mycobacterium tuberculosis Conserved protein 0.0036 0.0628 0.1285
Echinococcus granulosus transcriptional factor nfil3:e4bp4 0.0009 0.0047 0.0047
Brugia malayi Cytochrome P450 family protein 0.01 0.2028 0.348
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0027 0.0027
Schistosoma mansoni Smad4 0.0008 0.0027 0.0031
Mycobacterium ulcerans lipase LipD 0.0036 0.0628 0.5421
Mycobacterium leprae Probable lipase LipE 0.0036 0.0628 1
Leishmania major DNA polymerase eta, putative 0.0019 0.0265 0.2254
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0628 0.1069
Echinococcus multilocularis cpg binding protein 0.003 0.0501 0.0501
Echinococcus granulosus histone acetyltransferase KAT2B 0.0045 0.0817 0.0817
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0049 0.0911 0.0911
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0233 0.0468
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.3763 0.6466
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.0265 0.4158
Onchocerca volvulus Cirhin homolog 0.0115 0.2339 0.6208
Loa Loa (eye worm) RNA binding protein 0.013 0.2669 0.4583
Echinococcus granulosus cytochrome P450 2K1 0.0022 0.0321 0.0321
Entamoeba histolytica hypothetical protein 0.0113 0.2307 1
Trypanosoma cruzi cytochrome P450, putative 0.0022 0.0321 0.5056
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0893 0.1525
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0022 0.0321 0.0649
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0135 0.2064
Schistosoma mansoni beta-catenin 0.0116 0.2355 0.2717
Echinococcus granulosus dna polymerase kappa 0.0019 0.0265 0.0265
Loa Loa (eye worm) hypothetical protein 0.0052 0.0973 0.1663
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0022 0.0321 0.2741
Echinococcus multilocularis Smad4 0.0008 0.0027 0.0027
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0321 0.0541
Echinococcus multilocularis geminin 0.017 0.3527 0.3527
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.3763 0.6466
Schistosoma mansoni survival motor neuron protein 0.0048 0.0893 0.103
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0628 0.1069
Brugia malayi beta-lactamase 0.0036 0.0628 0.1069
Brugia malayi Cytochrome P450 family protein 0.0022 0.0321 0.0541
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0022 0.0321 0.0649
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.006 0.1153 1
Schistosoma mansoni hypothetical protein 0.0049 0.0911 0.1051
Loa Loa (eye worm) hypothetical protein 0.0106 0.2147 0.3684
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0144 0.2968 0.2968
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0394 0.3378
Schistosoma mansoni hypothetical protein 0.0406 0.8668 1
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0022 0.0321 0.0649
Loa Loa (eye worm) MH2 domain-containing protein 0.0122 0.25 0.4291
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0466 0.0789
Leishmania major hypothetical protein, conserved 0.0036 0.0628 0.5421
Echinococcus granulosus cpg binding protein 0.003 0.0501 0.0501
Schistosoma mansoni par domain protein 0.0009 0.0047 0.0054
Loa Loa (eye worm) hypothetical protein 0.0019 0.0256 0.0428
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0265 0.0445
Trichomonas vaginalis glucosylceramidase, putative 0.0275 0.5816 1
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.3763 0.6466
Echinococcus granulosus X box binding protein 1 0.0291 0.6172 0.6172
Mycobacterium tuberculosis Conserved protein 0.0036 0.0628 0.1285
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0394 0.08
Loa Loa (eye worm) transcription factor SMAD2 0.0122 0.25 0.4291
Schistosoma mansoni smad1 5 8 and 0.0008 0.0027 0.0031
Onchocerca volvulus 0.0036 0.0628 0.1654
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0022 0.0321 0.2741
Brugia malayi hypothetical protein 0.0236 0.4977 0.8556
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0022 0.0321 0.2741
Giardia lamblia DINP protein human, muc B family 0.0019 0.0265 0.3173
Trichomonas vaginalis glucosylceramidase, putative 0.0275 0.5816 1
Echinococcus granulosus protocadherin 11 0.0009 0.0047 0.0047
Schistosoma mansoni smad1 5 8 and 0.0008 0.0027 0.0031
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0022 0.0321 0.0649
Loa Loa (eye worm) hypothetical protein 0.0019 0.0265 0.0445
Echinococcus multilocularis neuropeptide receptor A26 0.0468 1 1
Echinococcus granulosus GPCR family 2 0.0049 0.0911 0.0911
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.0394 0.6232
Trypanosoma brucei cytochrome P450, putative 0.0022 0.0321 0.5056
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0265 0.0445
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0321 0.0541
Loa Loa (eye worm) beta-lactamase 0.0036 0.0628 0.1069
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0045 0.0817 0.7408
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0265 0.2254
Schistosoma mansoni cellular tumor antigen P53 0.0052 0.0973 0.1122
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0265 0.0534
Schistosoma mansoni cpg binding protein 0.003 0.0501 0.0578
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0022 0.0321 0.5056
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0265 0.4158
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0022 0.0321 0.0649
Loa Loa (eye worm) hypothetical protein 0.0025 0.0394 0.0666
Echinococcus granulosus survival motor neuron protein 1 0.0236 0.4977 0.4977
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.0394 0.1683
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0027 0.0027
Schistosoma mansoni transcriptional factor nfil3/e4bp4 0.0009 0.0047 0.0054
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0265 0.2254
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0045 0.0817 0.7408
Onchocerca volvulus Glucosylceramidase homolog 0.018 0.3763 1
Schistosoma mansoni hypothetical protein 0.0049 0.0911 0.1051
Onchocerca volvulus 0.0052 0.0973 0.2571
Brugia malayi Cell death specification protein 2 0.0009 0.0047 0.0068
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.013 0.2669 0.4583
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.0265 0.0445
Brugia malayi RNA binding protein 0.013 0.2669 0.4583
Onchocerca volvulus 0.0009 0.0047 0.0105
Plasmodium falciparum histone acetyltransferase GCN5 0.0041 0.0736 1
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.0628 0.1285
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0265 0.0265
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0022 0.0321 0.0649
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0049 0.0911 0.0911
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.3763 0.6466
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0628 0.1069
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0049 0.0911 0.0911
Mycobacterium ulcerans esterase/lipase LipP 0.0036 0.0628 0.5421
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0022 0.0321 0.5056
Echinococcus multilocularis transcriptional factor nfil3:e4bp4 0.0009 0.0047 0.0047
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.3763 0.6466
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0628 0.1069
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0022 0.0321 0.2741
Leishmania major cytochrome p450-like protein 0.0022 0.0321 0.2741
Plasmodium falciparum acyl-CoA synthetase 0.0019 0.0256 0.3409
Brugia malayi MH2 domain containing protein 0.0122 0.25 0.4291
Schistosoma mansoni hypothetical protein 0.0291 0.6172 0.7121
Brugia malayi beta-lactamase family protein 0.0036 0.0628 0.1069
Brugia malayi MH2 domain containing protein 0.0008 0.0027 0.0034
Mycobacterium ulcerans hypothetical protein 0.0025 0.0394 0.3378
Brugia malayi TAR-binding protein 0.013 0.2669 0.4583
Brugia malayi Hepatic leukemia factor 0.0009 0.0047 0.0068
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.0628 0.1285
Brugia malayi MH1 domain containing protein 0.0008 0.0027 0.0034
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0022 0.0321 0.2741
Schistosoma mansoni transcription factor LCR-F1 0.0113 0.2307 0.2662
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0394 0.08
Leishmania major cytochrome p450-like protein 0.0022 0.0321 0.2741
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0233 0.0468
Schistosoma mansoni hypothetical protein 0.0049 0.0911 0.1051
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0152 0.3148 0.3148
Loa Loa (eye worm) hypothetical protein 0.0009 0.0047 0.0068
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0394 0.3378
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.2968 0.3424
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0022 0.0321 0.0649
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.3974 0.6829
Loa Loa (eye worm) hypothetical protein 0.0009 0.0047 0.0068
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0628 0.1069
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Schistosoma mansoni hypothetical protein 0.0106 0.2147 0.2477
Echinococcus multilocularis smad 0.0008 0.0027 0.0027
Brugia malayi cytochrome P450 0.0022 0.0321 0.0541
Schistosoma mansoni thyrotroph embryonic factor related 0.0009 0.0047 0.0054
Loa Loa (eye worm) hypothetical protein 0.0025 0.0394 0.0666
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.0628 0.1285
Loa Loa (eye worm) hypothetical protein 0.0036 0.0628 0.1069
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.006 0.1153 0.1973
Toxoplasma gondii ABC1 family protein 0.0036 0.0628 0.5681
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0275 0.5816 1
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0038 0.0053
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0022 0.0321 0.2741
Loa Loa (eye worm) hypothetical protein 0.0036 0.0628 0.1069
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0038 0.0038
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.0628 0.1285
Trypanosoma cruzi cytochrome P450, putative 0.0022 0.0321 0.5056
Loa Loa (eye worm) hypothetical protein 0.0151 0.3129 0.5374
Brugia malayi beta-lactamase family protein 0.0036 0.0628 0.1069
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0394 0.3378
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Brugia malayi hypothetical protein 0.0009 0.0047 0.0068
Loa Loa (eye worm) hypothetical protein 0.0236 0.4977 0.8556
Echinococcus granulosus tumor protein p63 0.0354 0.7544 0.7544
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0144 0.2968 0.2968
Mycobacterium leprae putative cytochrome p450 0.0022 0.0321 0.5056
Entamoeba histolytica acyl-coA synthetase, putative 0.0025 0.0394 0.1683
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0022 0.0321 0.0649
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0265 0.0306
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.006 0.1153 0.1153
Schistosoma mansoni hypothetical protein 0.0113 0.2307 0.2662
Mycobacterium ulcerans hypothetical protein 0.0036 0.0628 0.5421
Echinococcus granulosus Smad4 0.0008 0.0027 0.0027
Echinococcus granulosus geminin 0.017 0.3527 0.3527
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0022 0.0321 0.0649
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0027 0.0027
Loa Loa (eye worm) cytochrome P450 family protein 0.01 0.2028 0.348
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Onchocerca volvulus 0.0009 0.0047 0.0105
Loa Loa (eye worm) hypothetical protein 0.0155 0.3212 0.5518
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0022 0.0321 0.2741
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.0628 0.1285
Mycobacterium tuberculosis Conserved protein 0.0036 0.0628 0.1285
Trypanosoma brucei unspecified product 0.0019 0.0265 0.4158
Schistosoma mansoni tar DNA-binding protein 0.013 0.2669 0.3079
Brugia malayi Cytochrome P450 family protein 0.0022 0.0321 0.0541
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0022 0.0321 0.2741
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.0628 0.1285
Brugia malayi bZIP transcription factor family protein 0.0009 0.0047 0.0068
Loa Loa (eye worm) HMP-2 protein 0.0116 0.2355 0.4042
Echinococcus multilocularis ccaat enhancer binding protein delta ccaat enhancer binding protein beta 0.0009 0.0047 0.0047
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0628 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0628 0.0725
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0022 0.0321 0.0649
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.0265 0.0445
Echinococcus granulosus histone acetyltransferase KAT2B 0.0148 0.3055 0.3055
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0022 0.0321 0.0649
Brugia malayi Smad1 0.0008 0.0027 0.0034
Echinococcus multilocularis protocadherin 11 0.0009 0.0047 0.0047
Onchocerca volvulus 0.0048 0.0893 0.2358
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.3763 0.6466
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0019 0.0256 0.0514
Brugia malayi Cell death specification protein 2 0.0009 0.0047 0.0068
Loa Loa (eye worm) cytochrome P450 0.0022 0.0321 0.0541
Brugia malayi hypothetical protein 0.0113 0.2307 0.396
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0265 0.4158
Schistosoma mansoni hypothetical protein 0.0009 0.0047 0.0054
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0394 0.0666
Echinococcus granulosus dnaJ subfamily B 0.0406 0.8668 0.8668
Schistosoma mansoni smad1 5 8 and 0.0008 0.0027 0.0031
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0007 0.0007 0.0007
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0152 0.3148 0.3632
Loa Loa (eye worm) hypothetical protein 0.0009 0.0047 0.0068
Schistosoma mansoni tar DNA-binding protein 0.013 0.2669 0.3079
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.116 0.1338
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0022 0.0321 0.5056
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0022 0.0321 0.0649
Entamoeba histolytica hypothetical protein 0.0113 0.2307 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.64 uM Inhibition of human GST tagged Tcf4/beta catenin interaction after 2 hrs using fluorescent AP Attophos substrate by ELISA analysis ChEMBL. 26944615

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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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