Detailed information for compound 437592

Basic information

Technical information
  • TDR Targets ID: 437592
  • Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]- 3,4-dihydro-2H-quinolin-3-yl]-N-(2-indol-1-yl ethyl)pyridine-2-sulfonamide
  • MW: 551.662 | Formula: C30H29N7O2S
  • H donors: 0 H acceptors: 5 LogP: 3.3 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: N#Cc1ccc2c(c1)CC(CN2Cc1cncn1C)N(S(=O)(=O)c1ccccn1)CCn1ccc2c1cccc2
  • InChi: 1S/C30H29N7O2S/c1-34-22-32-19-27(34)21-36-20-26(17-25-16-23(18-31)9-10-29(25)36)37(40(38,39)30-8-4-5-12-33-30)15-14-35-13-11-24-6-2-3-7-28(24)35/h2-13,16,19,22,26H,14-15,17,20-21H2,1H3
  • InChiKey: PXJNACPEASOODA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[2-(1-indolyl)ethyl]-2-pyridinesulfonamide

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
Leishmania major cytochrome p450-like protein 0.0008 0.0311 0.0494
Loa Loa (eye worm) hypothetical protein 0.0018 0.1223 0.1755
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0009 0.0439 0.0697
Schistosoma mansoni hypothetical protein 0.0008 0.0344 0.0344
Onchocerca volvulus 0.0018 0.1253 0.4215
Mycobacterium ulcerans oxidoreductase 0.0031 0.2501 0.3679
Trypanosoma cruzi cytochrome P450, putative 0.0008 0.0311 0.0494
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0008 0.0344 0.0344
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0012 0.0752 0.099
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0008 0.0311 0.0494
Brugia malayi Immunoglobulin I-set domain containing protein 0.0052 0.4445 0.6994
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0008 0.0344 0.0344
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0072 0.6296 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.3357 0.5223
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0012 0.0752 1
Echinococcus granulosus netrin receptor unc 5 0.0008 0.0344 0.0344
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Loa Loa (eye worm) hypothetical protein 0.0041 0.3357 0.5223
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0012 0.0752 0.2015
Loa Loa (eye worm) hypothetical protein 0.0041 0.3357 0.5223
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0006 0.0143 0.0143
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0024 0.1868 0.2012
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0012 0.0752 0.0752
Schistosoma mansoni hypothetical protein 0.0112 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0006 0.0143 0.0143
Echinococcus granulosus intermediate filament protein 0.0018 0.1253 0.1253
Onchocerca volvulus 0.0018 0.1253 0.4215
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0031 0.2501 0.3839
Trypanosoma cruzi aldo-keto reductase 0.0031 0.2501 0.3972
Trypanosoma cruzi aldo/keto reductase, putative 0.0009 0.0439 0.0697
Toxoplasma gondii cytochrome p450 superfamily protein 0.0008 0.0311 0.0494
Loa Loa (eye worm) hypothetical protein 0.0027 0.2069 0.313
Brugia malayi basement membrane proteoglycan precursor 0.0008 0.0344 0.0338
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0008 0.0344 0.0344
Toxoplasma gondii aldo-keto reductase 0.0009 0.0439 0.0697
Trichomonas vaginalis ap endonuclease, putative 0.0012 0.0752 0.0535
Schistosoma mansoni roundabout 0.0008 0.0344 0.0344
Loa Loa (eye worm) oxidoreductase 0.0031 0.2501 0.3832
Echinococcus multilocularis tyrosine protein kinase otk 0.0008 0.0344 0.0344
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0072 0.6296 1
Loa Loa (eye worm) hypothetical protein 0.0008 0.0366 0.0363
Leishmania major prostaglandin f synthase, putative 0.0031 0.2501 0.3972
Brugia malayi Cytochrome P450 family protein 0.0008 0.0311 0.0284
Schistosoma mansoni hypothetical protein 0.0008 0.0344 0.0344
Echinococcus multilocularis aldehyde reductase 0.0022 0.166 0.166
Loa Loa (eye worm) hypothetical protein 0.0018 0.1253 0.1804
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Echinococcus granulosus cpg binding protein 0.002 0.1461 0.1461
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Trichomonas vaginalis CMGC family protein kinase 0.0072 0.6296 1
Mycobacterium ulcerans hypothetical protein 0.0072 0.6264 1
Onchocerca volvulus 0.0031 0.2501 1
Echinococcus granulosus mitogen activated protein kinase 3 0.0072 0.6296 0.6296
Loa Loa (eye worm) oxidoreductase 0.0031 0.2501 0.3832
Echinococcus granulosus defective proboscis extension response 0.0041 0.3357 0.3357
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Schistosoma mansoni cell adhesion molecule 0.0008 0.0344 0.0344
Brugia malayi Peroxidasin 0.0008 0.0344 0.0338
Brugia malayi Cytochrome P450 family protein 0.0008 0.0311 0.0284
Echinococcus granulosus Immunoglobulin subtype 0.0008 0.0344 0.0344
Loa Loa (eye worm) CXXC zinc finger family protein 0.0019 0.1361 0.1979
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Echinococcus granulosus lamin 0.0018 0.1253 0.1253
Mycobacterium tuberculosis Conserved protein 0.0009 0.0439 0.0583
Schistosoma mansoni hypothetical protein 0.0008 0.0344 0.0344
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0012 0.0752 0.0752
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0041 0.3357 0.3357
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0008 0.0344 0.0344
Schistosoma mansoni cpg binding protein 0.0019 0.1361 0.1361
Echinococcus granulosus low density lipoprotein receptor ldl 0.0008 0.0344 0.0344
Trypanosoma brucei aldo-keto reductase, putative 0.0031 0.2501 0.3972
Schistosoma mansoni cpg binding protein 0.002 0.1461 0.1461
Mycobacterium ulcerans hypothetical protein 0.0009 0.0439 0.0215
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0024 0.1868 0.2967
Entamoeba histolytica alcohol dehydrogenase, putative 0.0009 0.0439 0.1754
Loa Loa (eye worm) cytochrome P450 0.0008 0.0311 0.0273
Brugia malayi hypothetical protein 0.0022 0.1593 0.2365
Schistosoma mansoni ap endonuclease 0.0012 0.0752 0.0752
Onchocerca volvulus 0.0009 0.0439 0.0438
Entamoeba histolytica alcohol dehydrogenase, putative 0.0009 0.0439 0.1754
Schistosoma mansoni nephrin related 0.0008 0.0344 0.0344
Onchocerca volvulus 0.0031 0.2501 1
Echinococcus granulosus hemicentin 1 0.0008 0.0344 0.0344
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0024 0.1868 0.1868
Echinococcus granulosus aldehyde reductase 0.0022 0.166 0.166
Schistosoma mansoni aldo-keto reductase 0.0031 0.2501 0.2501
Brugia malayi Prion-like- 0.0008 0.0344 0.0338
Brugia malayi MAP kinase sur-1 0.0072 0.6296 1
Echinococcus multilocularis lamin 0.0018 0.1253 0.1253
Plasmodium falciparum aldo-keto reductase, putative 0.0009 0.0439 0.5832
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0012 0.0752 0.5
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Loa Loa (eye worm) hypothetical protein 0.0041 0.3357 0.5223
Entamoeba histolytica aldose reductase, putative 0.0031 0.2501 1
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0009 0.0397 0.0397
Giardia lamblia Aldose reductase 0.0031 0.2501 0.3154
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Schistosoma mansoni vesicular amine transporter 0.0041 0.3357 0.3357
Brugia malayi Immunoglobulin domain containing protein 0.0008 0.0344 0.0338
Echinococcus multilocularis mitogen activated protein kinase 0.0072 0.6296 0.6296
Schistosoma mansoni cell adhesion molecule 0.0008 0.0344 0.0344
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0031 0.2501 0.3521
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Loa Loa (eye worm) cytochrome P450 family protein 0.0008 0.0311 0.0273
Echinococcus granulosus lamin dm0 0.0018 0.1253 0.1253
Brugia malayi Immunoglobulin I-set domain containing protein 0.0041 0.3357 0.5228
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0041 0.3357 0.3357
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0031 0.2501 0.3839
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0072 0.6296 1
Echinococcus granulosus Immunoglobulin 0.0008 0.0344 0.0344
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0024 0.1868 0.2967
Echinococcus granulosus peroxidasin 0.0008 0.0344 0.0344
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Loa Loa (eye worm) cytochrome P450 family protein 0.0035 0.2819 0.4349
Trypanosoma brucei prostaglandin f synthase 0.0031 0.2501 0.3972
Trichomonas vaginalis aldo/keto reductase, putative 0.0031 0.2501 0.3521
Loa Loa (eye worm) oxidoreductase 0.0031 0.2501 0.3832
Echinococcus granulosus Immunoglobulin 0.0041 0.3357 0.3357
Brugia malayi Immunoglobulin domain containing protein 0.0008 0.0344 0.0338
Schistosoma mansoni hypothetical protein 0.0112 1 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0018 0.1253 0.1804
Brugia malayi Intermediate filament tail domain containing protein 0.0018 0.1253 0.1813
Echinococcus granulosus aldo keto reductase 0.0031 0.2501 0.2501
Echinococcus multilocularis lachesin 0.0008 0.0344 0.0344
Echinococcus multilocularis peroxidasin 0.0008 0.0344 0.0344
Echinococcus multilocularis low density lipoprotein receptor (ldl) 0.0008 0.0344 0.0344
Echinococcus multilocularis neurotracting:lsamp:neurotrimin:obcam 0.0008 0.0344 0.0344
Schistosoma mansoni hypothetical protein 0.0022 0.1663 0.1663
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0012 0.0752 0.1195
Schistosoma mansoni cpg binding protein 0.002 0.1461 0.1461
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Trichomonas vaginalis CMGC family protein kinase 0.0072 0.6296 1
Brugia malayi NADH-dependent xylose reductase 0.0009 0.0439 0.0491
Brugia malayi basement membrane proteoglycan 0.0008 0.0344 0.0338
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0009 0.0439 0.048
Schistosoma mansoni serine/threonine protein kinase 0.0072 0.6296 0.6296
Echinococcus granulosus basement membrane specific heparan sulfate 0.0008 0.0344 0.0344
Echinococcus granulosus neuroglian 0.0008 0.0344 0.0344
Loa Loa (eye worm) hypothetical protein 0.0049 0.4103 0.6436
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0072 0.6296 1
Schistosoma mansoni septate junction protein 0.0008 0.0344 0.0344
Brugia malayi Fibronectin type III domain containing protein 0.0041 0.3357 0.5228
Echinococcus granulosus lachesin 0.0008 0.0344 0.0344
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0012 0.0752 0.0741
Entamoeba histolytica aldose reductase, putative 0.0031 0.2501 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0031 0.2501 0.3839
Brugia malayi bZIP transcription factor family protein 0.0027 0.2139 0.3251
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Loa Loa (eye worm) oxidoreductase 0.0031 0.2501 0.3832
Onchocerca volvulus 0.0031 0.2501 1
Echinococcus granulosus aldo keto reductase 0.0031 0.2501 0.2501
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Echinococcus granulosus tyrosine protein kinase otk 0.0008 0.0344 0.0344
Trichomonas vaginalis ap endonuclease, putative 0.0012 0.0752 0.0535
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0008 0.0344 0.0344
Schistosoma mansoni netrin receptor unc5 0.0008 0.0344 0.0344
Brugia malayi exodeoxyribonuclease III family protein 0.0012 0.0752 0.1
Echinococcus multilocularis Down syndrome cell adhesion molecule 0.0008 0.0344 0.0344
Echinococcus granulosus hypothetical protein 0.0031 0.2501 0.2501
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Schistosoma mansoni tyrosine kinase 0.0012 0.0686 0.0686
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0012 0.0752 1
Schistosoma mansoni titin 0.0008 0.0344 0.0344
Mycobacterium tuberculosis Probable oxidoreductase 0.0031 0.2501 1
Echinococcus multilocularis Immunoglobulin subtype 0.0008 0.0344 0.0344
Echinococcus multilocularis cell adhesion molecule:down regulated by 0.0008 0.0344 0.0344
Brugia malayi Cytochrome P450 family protein 0.0035 0.2819 0.4356
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0008 0.0344 0.0344
Loa Loa (eye worm) cytochrome P450 family protein 0.0008 0.0311 0.0273
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0008 0.0311 0.0494
Schistosoma mansoni netrin receptor unc5 0.0008 0.0344 0.0344
Echinococcus granulosus roundabout 2 0.0049 0.4103 0.4103
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0012 0.0752 0.3008
Echinococcus multilocularis geminin 0.0112 1 1
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0009 0.0439 0.0697
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0008 0.0344 0.0344
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Echinococcus granulosus neuroglian 0.0041 0.3357 0.3357
Brugia malayi Heparan sulfate 0.0008 0.0344 0.0338
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0008 0.0344 0.0344
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0049 0.4103 0.4103
Echinococcus granulosus aldo keto reductase 0.0031 0.2501 0.2501
Toxoplasma gondii aldose reductase, putative 0.0031 0.2501 0.3972
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0008 0.0311 0.0494
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0072 0.6296 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0031 0.2501 0.3839
Treponema pallidum exodeoxyribonuclease (exoA) 0.0012 0.0752 0.5
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0012 0.0752 0.1195
Schistosoma mansoni jun-related protein 0.0022 0.1663 0.1663
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0072 0.6296 1
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0009 0.0439 0.0697
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Toxoplasma gondii histone lysine methyltransferase SET1 0.0036 0.2938 0.4666
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0072 0.6296 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Echinococcus granulosus Immunoglobulin 0.0008 0.0344 0.0344
Loa Loa (eye worm) hypothetical protein 0.0041 0.3357 0.5223
Echinococcus granulosus cytochrome P450 2K1 0.0008 0.0311 0.0311
Schistosoma mansoni basigin related 0.0008 0.0344 0.0344
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0024 0.1868 0.1868
Brugia malayi CXXC zinc finger family protein 0.0019 0.1361 0.1988
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0008 0.0344 0.0327
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Schistosoma mansoni hypothetical protein 0.0008 0.0311 0.0311
Schistosoma mansoni neuroglian 0.0008 0.0344 0.0344
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0008 0.0344 0.0344
Schistosoma mansoni basigin related 0.0008 0.0344 0.0344
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0008 0.0344 0.0344
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.001 0.0485 0.0555
Giardia lamblia Kinase, CMGC MAPK 0.0072 0.6296 1
Schistosoma mansoni basigin related 0.0008 0.0344 0.0344
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0008 0.0344 0.0327
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0072 0.6296 1
Brugia malayi cytoplasmic intermediate filament protein 0.001 0.0485 0.0566
Trypanosoma cruzi aldo/keto reductase, putative 0.0031 0.2501 0.3972
Trichomonas vaginalis CMGC family protein kinase 0.0072 0.6296 1
Schistosoma mansoni hypothetical protein 0.0008 0.0344 0.0344
Schistosoma mansoni cell adhesion molecule 0.0008 0.0344 0.0344
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Schistosoma mansoni mixed-lineage leukemia protein mll 0.004 0.3337 0.3337
Schistosoma mansoni septate junction protein 0.0008 0.0344 0.0344
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Echinococcus multilocularis ubiquitin specific protease 41 0.0024 0.1868 0.1868
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0008 0.0311 0.0494
Loa Loa (eye worm) hypothetical protein 0.0049 0.4103 0.6436
Echinococcus granulosus mixed lineage leukemia protein mll 0.0005 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Echinococcus granulosus contactin 0.0008 0.0344 0.0344
Schistosoma mansoni nephrin 0.0041 0.3357 0.3357
Trichomonas vaginalis aldo/keto reductase, putative 0.0031 0.2501 0.3521
Schistosoma mansoni cell adhesion molecule 0.0049 0.4103 0.4103
Echinococcus granulosus ubiquitin specific protease 41 0.0024 0.1868 0.1868
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Echinococcus granulosus twitchin 0.0041 0.3417 0.3417
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Echinococcus multilocularis Immunoglobulin 0.0041 0.3357 0.3357
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0027 0.2139 0.2139
Schistosoma mansoni aldo-keto reductase 0.0031 0.2501 0.2501
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0012 0.0752 0.1195
Loa Loa (eye worm) hypothetical protein 0.0024 0.1868 0.2803
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0012 0.0752 0.1195
Echinococcus multilocularis musashi 0.0018 0.1253 0.1253
Echinococcus multilocularis aldo keto reductase 0.0031 0.2501 0.2501
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Schistosoma mansoni hypothetical protein 0.0008 0.0344 0.0344
Echinococcus multilocularis leucine rich repeat containing protein 4 0.0008 0.0344 0.0344
Trypanosoma brucei cytochrome P450, putative 0.0008 0.0311 0.0494
Plasmodium falciparum aldehyde reductase, putative 0.0009 0.0439 0.5832
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0027 0.2139 0.2139
Leishmania major cytochrome p450-like protein 0.0008 0.0311 0.0494
Toxoplasma gondii exonuclease III APE 0.0012 0.0752 0.1195
Echinococcus multilocularis mitogen activated protein kinase 3 0.0072 0.6296 0.6296
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0024 0.1868 0.7469
Leishmania major aldo-keto reductase-like protein 0.0031 0.2501 0.3972
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0031 0.2501 0.3972
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0024 0.1868 0.244
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0031 0.2501 1
Entamoeba histolytica aldose reductase, putative 0.0031 0.2501 1
Trypanosoma brucei aldo/keto reductase, putative 0.0009 0.0439 0.0697
Brugia malayi cytochrome P450 0.0008 0.0311 0.0284
Trypanosoma brucei RNA helicase, putative 0.0054 0.4595 0.7299
Echinococcus multilocularis neuroglian 0.0008 0.0344 0.0344
Schistosoma mansoni hypothetical protein 0.0054 0.4595 0.4595
Trypanosoma cruzi cytochrome P450, putative 0.0008 0.0311 0.0494
Loa Loa (eye worm) hypothetical protein 0.0009 0.0397 0.0412
Loa Loa (eye worm) hypothetical protein 0.0008 0.0366 0.0363
Echinococcus multilocularis voltage gated potassium channel subunit 0.0009 0.0439 0.0439
Brugia malayi Immunoglobulin I-set domain containing protein 0.0008 0.0344 0.0338
Schistosoma mansoni lamin 0.0018 0.1253 0.1253
Trichomonas vaginalis conserved hypothetical protein 0.0024 0.1868 0.244
Echinococcus multilocularis 0.0008 0.0311 0.0311
Onchocerca volvulus 0.0019 0.1361 0.4713
Giardia lamblia Aldose reductase 0.0031 0.2501 0.3154
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0024 0.1868 0.1868
Schistosoma mansoni lamin 0.0018 0.1253 0.1253
Echinococcus granulosus roundabout 2 0.0008 0.0344 0.0344
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0009 0.0439 0.0439
Schistosoma mansoni intermediate filament proteins 0.0018 0.1253 0.1253
Echinococcus granulosus voltage gated potassium channel subunit 0.0009 0.0439 0.0439
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0008 0.0344 0.0344
Onchocerca volvulus 0.0022 0.1593 0.579
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0031 0.2501 0.3521
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0005 0.0036 0.0036
Echinococcus multilocularis hemicentin 1 0.0008 0.0344 0.0344
Echinococcus multilocularis aldo keto reductase 0.0031 0.2501 0.2501
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0008 0.0344 0.0344
Echinococcus multilocularis aldo keto reductase 0.0031 0.2501 0.2501
Echinococcus granulosus pro neuregulin 2 membrane bound 0.0008 0.0344 0.0344
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Trypanosoma brucei protein kinase, putative 0.0072 0.6296 1
Loa Loa (eye worm) oxidoreductase 0.0031 0.2501 0.3832
Loa Loa (eye worm) hypothetical protein 0.0041 0.3357 0.5223
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Trichomonas vaginalis aldo/keto reductase, putative 0.0031 0.2501 0.3521
Leishmania major cytochrome p450-like protein 0.0008 0.0311 0.0494
Onchocerca volvulus 0.0031 0.2501 1
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0009 0.0439 0.0491
Schistosoma mansoni peroxidasin 0.0008 0.0344 0.0344
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0031 0.2501 0.3972
Echinococcus multilocularis Immunoglobulin 0.0008 0.0344 0.0344
Brugia malayi hypothetical protein 0.0041 0.3357 0.5228
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0072 0.6296 1
Schistosoma mansoni nephrin 0.0008 0.0344 0.0344
Echinococcus multilocularis roundabout 2 0.0049 0.4103 0.4103
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0008 0.0311 0.0494
Loa Loa (eye worm) hypothetical protein 0.0031 0.2501 0.3832
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0005 0.0036 0.0036
Schistosoma mansoni potassium channel beta 0.0009 0.0439 0.0439
Onchocerca volvulus 0.0031 0.2501 1
Echinococcus multilocularis jun protein 0.0027 0.2139 0.2139
Mycobacterium leprae Conserved hypothetical protein 0.0022 0.166 0.616
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Schistosoma mansoni cell adhesion molecule 0.0008 0.0344 0.0344
Echinococcus multilocularis hemicentin 1 0.0008 0.0344 0.0344
Echinococcus multilocularis pro neuregulin 2, membrane bound 0.0008 0.0344 0.0344
Echinococcus multilocularis neuroglian 0.0041 0.3357 0.3357
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Loa Loa (eye worm) intermediate filament protein 0.0018 0.1253 0.1804
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0008 0.0344 0.0327
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0008 0.0344 0.0344
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0005 0.0036 0.0036
Loa Loa (eye worm) immunoglobulin domain-containing protein 0.0008 0.0344 0.0327
Onchocerca volvulus 0.0031 0.2501 1
Brugia malayi Cytochrome P450 family protein 0.0008 0.0311 0.0284
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0041 0.3357 0.3357
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Echinococcus multilocularis Immunoglobulin 0.0008 0.0344 0.0344
Echinococcus multilocularis roundabout 2 0.0008 0.0344 0.0344
Mycobacterium leprae Possible oxidoreductase 0.0009 0.0439 0.0583
Echinococcus granulosus jun protein 0.0027 0.2139 0.2139
Echinococcus multilocularis Immunoglobulin 0.0041 0.3357 0.3357
Schistosoma mansoni pol-related 0.0031 0.2501 0.2501
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Loa Loa (eye worm) LAD-2 short isoform 0.0008 0.0344 0.0327
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0024 0.1868 0.1868
Echinococcus granulosus roundabout 2 0.0008 0.0344 0.0344
Brugia malayi Immunoglobulin domain containing protein 0.0008 0.0344 0.0338
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0008 0.0344 0.0327
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Echinococcus multilocularis roundabout 2 0.0008 0.0344 0.0344
Schistosoma mansoni cell adhesion molecule 0.0008 0.0344 0.0344
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0024 0.1868 0.1868
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0024 0.1868 0.1868
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0024 0.1868 0.2967
Brugia malayi hypothetical protein 0.0008 0.0344 0.0338
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0052 0.4445 0.6991
Echinococcus granulosus Down syndrome cell adhesion molecule 0.0008 0.0344 0.0344
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.2501 0.2501
Echinococcus multilocularis lamin dm0 0.0018 0.1253 0.1253
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.2501 0.2501
Echinococcus granulosus 3'partial|cell adhesion molecule:down regulated by 0.0008 0.0344 0.0344
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0024 0.1868 0.244
Brugia malayi intermediate filament protein 0.0018 0.1253 0.1813
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.2501 0.3521
Schistosoma mansoni cytochrome P450 0.0008 0.0311 0.0311
Echinococcus granulosus mitogen activated protein kinase 0.0072 0.6296 0.6296
Echinococcus multilocularis aldo keto reductase 0.0031 0.2501 0.2501
Echinococcus multilocularis netrin receptor unc 5 0.0008 0.0344 0.0344
Loa Loa (eye worm) CYP4Cod1 0.0008 0.0311 0.0273
Echinococcus multilocularis cpg binding protein 0.002 0.1461 0.1461
Schistosoma mansoni hypothetical protein 0.0008 0.0344 0.0344
Loa Loa (eye worm) hypothetical protein 0.0008 0.0344 0.0327
Loa Loa (eye worm) hypothetical protein 0.0049 0.4103 0.6436
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0009 0.0405 0.0425
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0005 0.0036 0.0036
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0024 0.1868 0.2811
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0024 0.1868 0.2967
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0031 0.2501 0.3521
Schistosoma mansoni septate junction protein 0.0008 0.0344 0.0344
Trichomonas vaginalis CMGC family protein kinase 0.0072 0.6296 1
Schistosoma mansoni septate junction protein 0.0008 0.0344 0.0344
Schistosoma mansoni ap endonuclease 0.0012 0.0752 0.0752
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0009 0.0397 0.0397

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 370 nM Antimalarial activity against Plasmodium falciparum 3D7 ChEMBL. 17722901
ED50 (functional) = 370 nM Antimalarial activity against Plasmodium falciparum 3D7 ChEMBL. 17722901
ED50 (functional) = 400 nM Antimalarial activity against Plasmodium falciparum K1 ChEMBL. 17722901
ED50 (functional) = 400 nM Antimalarial activity against Plasmodium falciparum K1 ChEMBL. 17722901
Inhibition (binding) = 10 % Inhibition of plasmodium falciparum protein farnesyltransferase at 0.5 nM by scintillation proximity assay ChEMBL. 17722901
Inhibition (binding) = 79 % Inhibition of plasmodium falciparum protein farnesyltransferase at 5 nM by scintillation proximity assay ChEMBL. 17722901
Inhibition (binding) = 98 % Inhibition of plasmodium falciparum protein farnesyltransferase at 50 nM by scintillation proximity assay ChEMBL. 17722901

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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