Detailed information for compound 1012785

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 527.393 | Formula: C22H19Cl2F3N6S
  • H donors: 3 H acceptors: 3 LogP: 8.53 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: CC(CNc1nc(Nc2ccc(cc2)C(F)(F)F)c2c(n1)sc(n2)Nc1c(Cl)cccc1Cl)C
  • InChi: 1S/C22H19Cl2F3N6S/c1-11(2)10-28-20-32-18(29-13-8-6-12(7-9-13)22(25,26)27)17-19(33-20)34-21(31-17)30-16-14(23)4-3-5-15(16)24/h3-9,11H,10H2,1-2H3,(H,30,31)(H2,28,29,32,33)
  • InChiKey: KXBDRWINDHCJDI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens transient receptor potential cation channel, subfamily V, member 1 Starlite/ChEMBL References
Rattus norvegicus Vanilloid receptor Starlite/ChEMBL References

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
Brugia malayi steroid hormone receptor 0.003 0.0046 0.0178
Brugia malayi latrophilin 2 splice variant baaae 0.007 0.0208 0.0806
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.003 0.0046 0.0178
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.003 0.0046 0.0408
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.007 0.0208 0.3728
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.005 0.0517
Plasmodium vivax phenylalanine--tRNA ligase, putative 0.0042 0.0092 0.1371
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0119 0.1064
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0032 0.005 0.0517
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.051 0.4546
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0114 0.0392 0.7497
Echinococcus multilocularis lipoxygenase domain containing protein 0.0038 0.0078 0.0078
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0114 0.0392 0.2656
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0032 0.005 0.0517
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0143 0.051 0.198
Loa Loa (eye worm) hypothetical protein 0.0032 0.0053 0.0206
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0148 0.0529 0.177
Brugia malayi Latrophilin receptor protein 2 0.0032 0.0053 0.0206
Loa Loa (eye worm) hypothetical protein 0.0025 0.0025 0.0098
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0089 0.0287 0.1945
Echinococcus granulosus ecdysone induced protein 78C 0.003 0.0046 0.031
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.1167 0.3965
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0231 0.0874 1
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0114 0.0392 0.2656
Echinococcus multilocularis phenylalanyl tRNA synthetase alpha chain B 0.0144 0.0514 0.0514
Echinococcus granulosus thioredoxin glutathione reductase 0.0092 0.0299 0.2024
Echinococcus granulosus lipoxygenase domain containing protein 0.0038 0.0078 0.0531
Loa Loa (eye worm) hypothetical protein 0.0047 0.0114 0.0444
Schistosoma mansoni nuclear hormone receptor 0.003 0.0046 0.0408
Brugia malayi hypothetical protein 0.0169 0.0616 0.2393
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0092 0.0301 0.2683
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.051 0.4546
Schistosoma mansoni single-minded 0.005 0.0128 0.1137
Onchocerca volvulus 0.0048 0.0119 0.0254
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.1167 0.3965
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0178
Brugia malayi Pre-SET motif family protein 0.0092 0.0301 0.1169
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0074 0.0224 0.0224
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0143 0.051 0.198
Echinococcus granulosus expressed protein 0.0377 0.1476 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.003 0.0046 0.0178
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0303 0.1167 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0092 0.0299 0.0299
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0092 0.0301 0.2683
Entamoeba histolytica hypothetical protein 0.0074 0.0224 0.1916
Schistosoma mansoni coup transcription factor 0.003 0.0046 0.0408
Onchocerca volvulus Huntingtin homolog 0.012 0.0414 0.127
Brugia malayi Nuclear hormone receptor family member nhr-19 0.003 0.0046 0.0178
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0114 0.0392 0.3493
Brugia malayi Nuclear hormone receptor family member nhr-49 0.003 0.0046 0.0178
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0114 0.0444
Trypanosoma cruzi trypanothione reductase, putative 0.0091 0.0296 0.5541
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.1167 0.3965
Brugia malayi photoreceptor-specific nuclear receptor 0.003 0.0046 0.0178
Mycobacterium tuberculosis Probable reductase 0.0208 0.0778 0.2691
Plasmodium vivax phenylalanine--tRNA ligase alpha subunit, putative 0.0144 0.0514 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.1167 0.3965
Schistosoma mansoni aldehyde dehydrogenase 0.007 0.0208 0.185
Brugia malayi Nuclear hormone receptor family member nhr-31 0.003 0.0046 0.0178
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0092 0.0301 0.2683
Brugia malayi hypothetical protein 0.0038 0.0078 0.0304
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0114 0.0392 0.3059
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0208 0.0778 0.2691
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0143 0.051 0.3457
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0032 0.005 0.0517
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0032 0.005 0.0517
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.0208 0.0581
Brugia malayi nuclear hormone receptor 0.003 0.0046 0.0178
Trichomonas vaginalis mercuric reductase, putative 0.0032 0.005 0.0171
Schistosoma mansoni aldehyde dehydrogenase 0.007 0.0208 0.185
Plasmodium falciparum LCCL domain-containing protein 0.0038 0.0078 0.1087
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.1167 0.3965
Trichomonas vaginalis phenylalanyl-tRNA synthetase alpha chain, putative 0.0042 0.0092 0.0313
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0032 0.005 0.0517
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0092 0.0301 0.0301
Loa Loa (eye worm) hypothetical protein 0.0092 0.0301 0.1169
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0178
Schistosoma mansoni transcription factor LCR-F1 0.0074 0.0224 0.1992
Echinococcus multilocularis GPCR, family 2 0.0032 0.0053 0.0053
Toxoplasma gondii aldehyde dehydrogenase 0.007 0.0208 0.3728
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0032 0.0053 0.036
Treponema pallidum fructose-bisphosphate aldolase 0.0303 0.1167 1
Echinococcus granulosus tumor protein p63 0.033 0.1281 0.8683
Schistosoma mansoni phenylalanyl-tRNA synthetase subunit alpha 0.0042 0.0092 0.0822
Plasmodium falciparum thioredoxin reductase 0.0091 0.0296 0.5541
Toxoplasma gondii NADPH-glutathione reductase 0.0032 0.005 0.0517
Trichomonas vaginalis conserved hypothetical protein 0.0114 0.0392 0.1332
Trypanosoma cruzi trypanothione reductase, putative 0.0032 0.005 0.0517
Schistosoma mansoni thyroid hormone receptor 0.003 0.0046 0.0408
Loa Loa (eye worm) glutathione reductase 0.0091 0.0296 0.115
Schistosoma mansoni phenylalanyl-tRNA synthetase mitochondrial 0.0042 0.0092 0.0822
Loa Loa (eye worm) steroid hormone receptor 0.003 0.0046 0.0178
Echinococcus multilocularis tumor protein p63 0.033 0.1281 0.1281
Schistosoma mansoni hypothetical protein 0.0032 0.0053 0.0474
Schistosoma mansoni hypothetical protein 0.0175 0.0643 0.573
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0178
Schistosoma mansoni hypothetical protein 0.0175 0.0643 0.573
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.0208 0.0581
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.007 0.0208 0.1407
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0114 0.0392 0.7497
Echinococcus granulosus histone lysine methyltransferase setb 0.0092 0.0301 0.204
Schistosoma mansoni hypothetical protein 0.0032 0.0053 0.0474
Echinococcus granulosus phenylalanyl tRNA synthetase 0.0042 0.0092 0.0625
Echinococcus multilocularis expressed protein 0.0377 0.1476 0.1476
Brugia malayi bHLH-PAS transcription factor 0.0037 0.0074 0.0286
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0032 0.005 0.0517
Plasmodium vivax multidomain scavenger receptor, putative 0.0038 0.0078 0.1087
Schistosoma mansoni thyroid hormone receptor 0.003 0.0046 0.0408
Loa Loa (eye worm) hypothetical protein 0.0114 0.0392 0.1522
Schistosoma mansoni hypothetical protein 0.0032 0.0053 0.0474
Schistosoma mansoni steroid hormone receptor ad4bp 0.003 0.0046 0.0408
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0178
Onchocerca volvulus 0.0734 0.2944 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.003 0.0046 0.0178
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0231 0.0874 0.3045
Echinococcus granulosus nuclear receptor 2DBD gamma 0.003 0.0046 0.031
Onchocerca volvulus 0.0037 0.0074 0.0096
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.003 0.0046 0.0178
Brugia malayi Steroid receptor seven-up type 2 0.003 0.0046 0.0178
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.003 0.0046 0.0046
Trypanosoma brucei phenylalanyl-tRNA synthetase alpha chain, putative 0.0144 0.0514 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0032 0.0053 0.036
Mycobacterium ulcerans putative regulatory protein 0.0037 0.0074 0.0086
Echinococcus multilocularis FTZ F1 alpha 0.003 0.0046 0.0046
Trichomonas vaginalis glutathione reductase, putative 0.0032 0.005 0.0171
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0114 0.0979
Brugia malayi hypoxia-induced factor 1 0.0156 0.0562 0.2183
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0032 0.005 0.0517
Schistosoma mansoni hypothetical protein 0.0074 0.0224 0.1992
Brugia malayi nuclear receptor NHR-88 0.003 0.0046 0.0178
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.003 0.0046 0.0046
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0047 0.0114 0.0388
Echinococcus multilocularis transfer RNA-Lys 0.0037 0.0074 0.0074
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.0418 0.1622
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0102 0.0341 0.1322
Loa Loa (eye worm) hypothetical protein 0.0169 0.0616 0.2393
Trichomonas vaginalis phenylalanyl-tRNA synthetase alpha chain, putative 0.0042 0.0092 0.0313
Schistosoma mansoni hypothetical protein 0.0038 0.0078 0.0698
Brugia malayi ecdysteroid receptor 0.003 0.0046 0.0178
Loa Loa (eye worm) hypothetical protein 0.0144 0.0514 0.1997
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0074 0.0224 0.1515
Chlamydia trachomatis phenylalanine--tRNA ligase subunit alpha 0.0688 0.2755 1
Brugia malayi Doublecortin family protein 0.0038 0.0078 0.0304
Plasmodium vivax thioredoxin reductase, putative 0.0091 0.0296 0.5541
Loa Loa (eye worm) hypothetical protein 0.0048 0.0119 0.0463
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0047 0.0114 0.1018
Schistosoma mansoni hypothetical protein 0.007 0.0208 0.1849
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0092 0.0301 0.5638
Brugia malayi hypothetical protein 0.012 0.0414 0.1606
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0178
Leishmania major trypanothione reductase 0.0091 0.0296 0.5541
Brugia malayi Nuclear hormone receptor-like 1 0.003 0.0046 0.0178
Wolbachia endosymbiont of Brugia malayi phenylalanyl-tRNA synthetase subunit alpha 0.0688 0.2755 1
Loa Loa (eye worm) hypothetical protein 0.012 0.0414 0.1606
Echinococcus multilocularis Polycystic kidney disease protein 0.0038 0.0078 0.0078
Schistosoma mansoni rab6-interacting 0.0038 0.0078 0.0698
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0092 0.0301 0.2683
Brugia malayi hypothetical protein 0.0038 0.0078 0.0304
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0208 0.0778 0.8199
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.007 0.0208 0.0581
Echinococcus granulosus nuclear receptor 2DBD gamma 0.003 0.0046 0.031
Treponema pallidum phenylalanyl-tRNA synthetase subunit alpha 0.0144 0.0514 0.4156
Onchocerca volvulus 0.0038 0.0078 0.0113
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0032 0.005 0.0517
Schistosoma mansoni RAR-like nuclear receptor 0.003 0.0046 0.0408
Echinococcus multilocularis ubiquitin specific protease 41 0.0114 0.0392 0.0392
Echinococcus multilocularis ecdysone induced protein 78C 0.003 0.0046 0.0046
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0032 0.005 0.0517
Onchocerca volvulus 0.0038 0.0078 0.0113
Schistosoma mansoni aryl hydrocarbon receptor 0.005 0.0128 0.1137
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0023 0.0016 0.0062
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.003 0.0046 0.0046
Schistosoma mansoni lipoxygenase 0.0108 0.0363 0.3237
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0032 0.005 0.0517
Plasmodium falciparum phenylalanine--tRNA ligase alpha subunit 0.0144 0.0514 1
Loa Loa (eye worm) phenylalanyl-tRNA synthetase 0.0042 0.0092 0.0358
Loa Loa (eye worm) hypothetical protein 0.007 0.0208 0.0806
Brugia malayi hypothetical protein 0.0074 0.0224 0.0868
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0208 0.0778 0.2691
Loa Loa (eye worm) hypothetical protein 0.0038 0.0078 0.0304
Schistosoma mansoni lipoxygenase 0.0038 0.0078 0.0698
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.003 0.0046 0.0178
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0108 0.0363 0.2461
Schistosoma mansoni retinoid-x-receptor (RXR) 0.003 0.0046 0.0408
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.003 0.0046 0.0046
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0047 0.0114 0.1018
Brugia malayi Pre-SET motif family protein 0.0644 0.2576 1
Mycobacterium tuberculosis Probable dehydrogenase 0.0208 0.0778 0.2691
Echinococcus multilocularis geminin 0.0175 0.0643 0.0643
Loa Loa (eye worm) thioredoxin reductase 0.0091 0.0296 0.115
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.003 0.0046 0.031
Echinococcus granulosus phenylalanyl tRNA synthetase alpha chain B 0.0144 0.0514 0.3486
Echinococcus granulosus lipoxygenase domain containing protein 0.0038 0.0078 0.0531
Plasmodium falciparum phenylalanine--tRNA ligase 0.0042 0.0092 0.1371
Echinococcus multilocularis RUN 0.0038 0.0078 0.0078
Leishmania major phenylalanyl-tRNA synthetase alpha chain, putative 0.0144 0.0514 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0208 0.0778 0.2691
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0032 0.005 0.0517
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0032 0.005 0.0342
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0032 0.005 0.005
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.003 0.0046 0.0178
Brugia malayi Nuclear hormone receptor family member nhr-25 0.003 0.0046 0.0178
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0143 0.051 0.3457
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0032 0.0053 0.0053
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0148 0.0529 0.177
Schistosoma mansoni loxhd1 0.0038 0.0078 0.0698
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0208 0.0778 0.2691
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.005 0.0517
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0231 0.0874 0.3045
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.003 0.0046 0.0408
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.003 0.0046 0.031
Echinococcus granulosus single minded 2 0.0037 0.0074 0.0499
Brugia malayi PAS domain containing protein 0.005 0.0128 0.0496
Loa Loa (eye worm) hypothetical protein 0.0038 0.0078 0.0304
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0114 0.0392 0.1332
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.003 0.0046 0.031
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.005 0.0517
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0114 0.0392 0.7497
Plasmodium vivax sentrin-specific protease 1, putative 0.0047 0.0114 0.1821
Schistosoma mansoni polycystin 1-related 0.0038 0.0078 0.0698
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0114 0.0392 0.0392
Giardia lamblia Phenylalanyl-tRNA synthetase alpha chain 0.0144 0.0514 0.4156
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0143 0.051 0.051
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0091 0.0296 0.0909
Plasmodium falciparum thioredoxin reductase 0.0032 0.005 0.0517
Toxoplasma gondii Ferredoxin-fold anticodon binding domain-containing protein 0.0042 0.0092 0.1371
Brugia malayi Nuclear hormone receptor family member nhr-40 0.003 0.0046 0.0178
Mycobacterium tuberculosis Probable phenylalanyl-tRNA synthetase, alpha chain PheS 0.0688 0.2755 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0032 0.005 0.0517
Entamoeba histolytica hypothetical protein 0.0074 0.0224 0.1916
Plasmodium falciparum glutathione reductase 0.0032 0.005 0.0517
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.003 0.0046 0.031
Brugia malayi Nuclear hormone receptor family member nhr-3 0.003 0.0046 0.0178
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0178
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0148 0.0529 0.3515
Echinococcus granulosus Polycystic kidney disease protein 0.0038 0.0078 0.0531
Plasmodium falciparum glutathione reductase 0.0091 0.0296 0.5541
Echinococcus granulosus FTZ F1 alpha 0.003 0.0046 0.031
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0644 0.2576 1
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0114 0.0392 0.3493
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0178
Mycobacterium ulcerans phenylalanyl-tRNA synthetase subunit alpha 0.0688 0.2755 1
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0303 0.1167 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.003 0.0046 0.0178
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.1167 0.3965
Giardia lamblia Fructose-bisphosphate aldolase 0.0303 0.1167 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.005 0.0517
Loa Loa (eye worm) hypoxia-induced factor 1 0.0156 0.0562 0.2183
Onchocerca volvulus 0.0092 0.0301 0.0881
Brugia malayi phenylalanyl-tRNA synthetase, mitochondrial precursor, putative 0.0042 0.0092 0.0358
Echinococcus multilocularis sentrin specific protease 1 0.0047 0.0114 0.0114
Brugia malayi MH2 domain containing protein 0.0121 0.0418 0.1622
Echinococcus granulosus sentrin specific protease 1 0.0047 0.0114 0.0774
Brugia malayi Thioredoxin reductase 0.0091 0.0296 0.115
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.003 0.0046 0.0178
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.003 0.0046 0.0046
Mycobacterium tuberculosis Probable oxidoreductase 0.0231 0.0874 0.3045
Echinococcus multilocularis thyroid hormone receptor alpha 0.003 0.0046 0.0046
Entamoeba histolytica hypothetical protein 0.0074 0.0224 0.1916
Loa Loa (eye worm) doublecortin family protein 0.0038 0.0078 0.0304
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.005 0.0517
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.003 0.0046 0.0408
Entamoeba histolytica phenylalanyl-tRNA synthetase alpha subunit, putative 0.0144 0.0514 0.4409
Brugia malayi phenylalanyl (f) trna synthetase protein 1 0.0144 0.0514 0.1997
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0032 0.0053 0.0053
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.003 0.0046 0.0178
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.0053 0.0206
Loa Loa (eye worm) hypothetical protein 0.0102 0.0341 0.1322
Echinococcus granulosus ubiquitin specific protease 41 0.0114 0.0392 0.2656
Loa Loa (eye worm) hypothetical protein 0.012 0.0414 0.1606
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.1167 0.3965
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.003 0.0046 0.0178
Trypanosoma brucei trypanothione reductase 0.0091 0.0296 0.5541
Echinococcus multilocularis lipoxygenase domain containing protein 0.0038 0.0078 0.0078
Trypanosoma cruzi phenylalanyl-tRNA synthetase alpha chain, putative 0.0144 0.0514 1
Echinococcus granulosus geminin 0.0175 0.0643 0.4357
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.0053 0.0206
Entamoeba histolytica hypothetical protein 0.0074 0.0224 0.1916
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.1167 0.3965
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.003 0.0046 0.0408
Echinococcus granulosus retinoic acid receptor rxr beta a 0.003 0.0046 0.031
Plasmodium vivax SET domain protein, putative 0.0092 0.0301 0.5638
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0114 0.0392 0.1522
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0023 0.0016 0.0062
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.0208 0.0581
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.003 0.0046 0.0178
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0114 0.0392 0.1332
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0032 0.005 0.0517
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.007 0.0208 0.0208
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0108 0.0363 0.0363
Plasmodium falciparum phenylalanine--tRNA ligase 0.0042 0.0092 0.1371
Schistosoma mansoni Tr4/Tr2 (homologue) 0.003 0.0046 0.0408
Toxoplasma gondii thioredoxin reductase 0.0091 0.0296 0.5541
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0032 0.005 0.0196
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0047 0.0114 0.1821
Brugia malayi glutathione reductase 0.0091 0.0296 0.115
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0143 0.051 0.051
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0114 0.0392 0.0392
Brugia malayi Nuclear hormone receptor family member nhr-14 0.003 0.0046 0.0178
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0032 0.005 0.0517
Trichomonas vaginalis set domain proteins, putative 0.0733 0.2943 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0178
Plasmodium vivax phenylalanine--tRNA ligase, putative 0.0042 0.0092 0.1371
Schistosoma mansoni retinoic acid receptor RXR 0.003 0.0046 0.0408
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0032 0.005 0.0517
Brugia malayi Nuclear hormone receptor family member nhr-41 0.003 0.0046 0.0178
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.003 0.0046 0.0046
Echinococcus granulosus RUN 0.0038 0.0078 0.0531
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0102 0.0341 0.1322
Brugia malayi Calcitonin receptor-like protein seb-1 0.0102 0.0341 0.1322
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0032 0.005 0.045
Plasmodium vivax glutathione reductase, putative 0.0091 0.0296 0.5541
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0114 0.0392 0.7497
Echinococcus multilocularis phenylalanyl tRNA synthetase 0.0042 0.0092 0.0092
Schistosoma mansoni phenylalanyl-tRNA synthetase subunit alpha 0.0144 0.0514 0.4585
Brugia malayi Nuclear hormone receptor family member nhr-19 0.003 0.0046 0.0178
Schistosoma mansoni hypothetical protein 0.0032 0.0053 0.0474
Toxoplasma gondii phenylalanyl-tRNA synthetase alpha chain A, putative 0.0144 0.0514 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0092 0.0301 0.0301
Echinococcus granulosus GPCR family 2 0.0032 0.0053 0.036
Brugia malayi hypothetical protein 0.0025 0.0025 0.0098
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.0418 0.1622
Schistosoma mansoni rab6-interacting 0.0038 0.0078 0.0698
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0114 0.0392 0.3359
Plasmodium falciparum sentrin-specific protease 1 0.0047 0.0114 0.1821
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.005 0.0517
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.051 0.4546
Trichomonas vaginalis phenylalanyl-tRNA synthetase alpha chain, putative 0.0144 0.0514 0.1748
Onchocerca volvulus Huntingtin homolog 0.012 0.0414 0.127

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 1 nM Antagonist activity at rat TRPV1 expressed in HEK293 cells assessed as inhibition of capsaicin-induced calcium flux ChEMBL. 19038548
IC50 (functional) = 2 nM Antagonist activity at human TRPV1 expressed in HEK293 cells assessed as inhibition of capsaicin-induced calcium flux ChEMBL. 19038548

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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