Detailed information for compound 1630674

Basic information

Technical information
  • TDR Targets ID: 1630674
  • Name: 2-amino-4-(4-methoxyphenyl)-6-[4-[[7-(trifluo romethyl)quinolin-4-yl]amino]phenyl]pyridine- 3-carbonitrile
  • MW: 511.497 | Formula: C29H20F3N5O
  • H donors: 2 H acceptors: 3 LogP: 6.73 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1ccc(cc1)c1cc(nc(c1C#N)N)c1ccc(cc1)Nc1ccnc2c1ccc(c2)C(F)(F)F
  • InChi: 1S/C29H20F3N5O/c1-38-21-9-4-17(5-10-21)23-15-26(37-28(34)24(23)16-33)18-2-7-20(8-3-18)36-25-12-13-35-27-14-19(29(30,31)32)6-11-22(25)27/h2-15H,1H3,(H2,34,37)(H,35,36)
  • InChiKey: UYWPQCPEYPUKEV-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-amino-4-(4-methoxyphenyl)-6-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenyl]pyridine-3-carbonitrile
  • 2-amino-4-(4-methoxyphenyl)-6-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenyl]-3-pyridinecarbonitrile
  • 2-amino-4-(4-methoxyphenyl)-6-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenyl]nicotinonitrile
  • NCI60_036416
  • NSC701384

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
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0107 0.0268 0.0241
Loa Loa (eye worm) neuropeptide F receptor 0.0107 0.0268 0.6459
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0107 0.0268 0.0252
Schistosoma mansoni hypothetical protein 0.0107 0.0268 0.0241
Brugia malayi putative neuropeptide receptor NPR1 0.0107 0.0268 0.6312
Brugia malayi Cathepsin L-like precursor 0.0091 0.0209 0.4839
Echinococcus granulosus dro:myosuppressin receptor 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Schistosoma mansoni neuropeptide receptor 0.0107 0.0268 0.0241
Toxoplasma gondii cathepsin CPL 0.0091 0.0209 0.0124
Echinococcus multilocularis g protein coupled receptor 0.0107 0.0268 0.0252
Echinococcus granulosus G protein coupled receptor 139 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Brugia malayi Cathepsin L-like precursor 0.0091 0.0209 0.4839
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) TYRA-2 protein 0.0107 0.0268 0.6459
Schistosoma mansoni biogenic amine (5HT) receptor 0.0107 0.0268 0.0241
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0107 0.0268 0.6459
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni opsin-like receptor 0.0107 0.0268 0.0241
Onchocerca volvulus 0.0091 0.0209 0.6318
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0049 0.0062 0.0098
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0091 0.0209 0.0193
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0149 0.0415 1
Onchocerca volvulus 0.0091 0.0209 0.6318
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Brugia malayi follicle stimulating hormone receptor 0.0107 0.0268 0.6312
Loa Loa (eye worm) hypothetical protein 0.0149 0.0415 1
Echinococcus granulosus tm gpcr rhodopsin 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0049 0.0062 0.0098
Echinococcus multilocularis allatostatin A receptor 0.0107 0.0268 0.0252
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0107 0.0268 0.6459
Echinococcus granulosus allatostatin A receptor 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus multilocularis fmrfamide receptor 0.0107 0.0268 0.0252
Giardia lamblia Dipeptidyl-peptidase I precursor 0.0975 0.332 0.3694
Schistosoma mansoni neuropeptide receptor 0.0107 0.0268 0.0241
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0107 0.0268 0.0241
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Leishmania major cathepsin L-like protease 0.0091 0.0209 1
Schistosoma mansoni cathepsin F (C01 family) 0.0062 0.0109 0.0081
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0107 0.0268 0.0241
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Brugia malayi Cathepsin L-like precursor 0.0091 0.0209 0.4839
Brugia malayi Cathepsin L-like precursor 0.0091 0.0209 0.4839
Loa Loa (eye worm) neuropeptide F receptor 0.0107 0.0268 0.6459
Echinococcus granulosus cathepsin l cysteine peptidase 0.0091 0.0209 0.0193
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0107 0.0268 0.0252
Onchocerca volvulus Cathepsin L homolog 0.0091 0.0209 0.6318
Echinococcus granulosus cathepsin b 0.0149 0.0415 0.0399
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Brugia malayi G-protein coupled receptor 0.0107 0.0268 0.6312
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0062 0.0109 0.0184
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0149 0.0415 0.0388
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0107 0.0268 0.0241
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0107 0.0268 0.0252
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0107 0.0268 0.0252
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0149 0.0415 0.0388
Schistosoma mansoni biogenic amine (5HT) receptor 0.0107 0.0268 0.0241
Echinococcus granulosus biogenic amine 5HT receptor 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni biogenic amine receptor 0.0107 0.0268 0.0241
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus granulosus cathepsin l1 0.0091 0.0209 0.0193
Echinococcus multilocularis neuropeptide receptor 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Toxoplasma gondii cathepsin CPC1 0.2536 0.8813 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Onchocerca volvulus 0.0107 0.0268 1
Entamoeba histolytica cysteine protease, putative 0.0091 0.0209 1
Onchocerca volvulus 0.0107 0.0268 1
Echinococcus multilocularis cathepsin L 0.0049 0.0062 0.0045
Brugia malayi Dopamine receptor 0.0107 0.0268 0.6312
Plasmodium falciparum dipeptidyl aminopeptidase 1 0.2536 0.8813 1
Loa Loa (eye worm) ctsf protein 0.0091 0.0209 0.5046
Schistosoma mansoni cathepsin F (C01 family) 0.0091 0.0209 0.0182
Leishmania major cathepsin L-like protease 0.0091 0.0209 1
Brugia malayi Tachykinin-like peptides receptor 99D 0.0107 0.0268 0.6312
Plasmodium vivax dipeptidyl aminopeptidase 2, putative 0.2536 0.8813 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Echinococcus multilocularis rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0107 0.0268 1
Onchocerca volvulus Cathepsin L homolog 0.0091 0.0209 0.6318
Schistosoma mansoni hypothetical protein 0.0107 0.0268 0.0241
Echinococcus multilocularis rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0149 0.0415 0.0388
Loa Loa (eye worm) hypothetical protein 0.0091 0.0209 0.5046
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Brugia malayi Cathepsin L-like precursor 0.0091 0.0209 0.4839
Loa Loa (eye worm) hypothetical protein 0.0062 0.0109 0.262
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0107 0.0268 0.0252
Echinococcus multilocularis somatostatin receptor 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.006 0.0101 0.0171
Brugia malayi Cathepsin L-like precursor 0.0062 0.0109 0.2313
Loa Loa (eye worm) cathepsin B 0.006 0.0101 0.2446
Echinococcus multilocularis neuropeptide Y receptor 0.0107 0.0268 0.0252
Echinococcus granulosus neuropeptide receptor 0.0107 0.0268 0.0252
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Schistosoma mansoni biogenic amine receptor 0.0107 0.0268 0.0241
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0091 0.0209 0.0193
Trypanosoma cruzi cysteine peptidase, putative 0.0091 0.0209 0.4179
Plasmodium falciparum dipeptidyl aminopeptidase 3 0.0975 0.332 0.3723
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus multilocularis rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0107 0.0268 0.0252
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0107 0.0268 0.6312
Brugia malayi Papain family cysteine protease containing protein 0.0049 0.0062 0.1134
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Brugia malayi Papain family cysteine protease containing protein 0.0091 0.0209 0.4839
Onchocerca volvulus 0.0107 0.0268 1
Schistosoma mansoni hypothetical protein 0.0107 0.0268 0.0241
Schistosoma mansoni amine GPCR 0.0107 0.0268 0.0241
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0049 0.0062 0.0034
Echinococcus granulosus tm gpcr rhodopsin 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Plasmodium falciparum dipeptidyl aminopeptidase 2 0.2536 0.8813 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Onchocerca volvulus 0.0107 0.0268 1
Leishmania major cathepsin L-like protease 0.0091 0.0209 1
Schistosoma mansoni histamine h1 receptor 0.0107 0.0268 0.0241
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0107 0.0268 0.0252
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Brugia malayi Papain family cysteine protease containing protein 0.0049 0.0062 0.1134
Brugia malayi sulfakinin receptor protein 0.0107 0.0268 0.6312
Schistosoma mansoni cathepsin F (C01 family) 0.0091 0.0209 0.0182
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0107 0.0268 0.6459
Echinococcus multilocularis serotonin receptor 0.0107 0.0268 0.0252
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0107 0.0268 0.0241
Echinococcus multilocularis rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0107 0.0268 0.0252
Onchocerca volvulus 0.0091 0.0209 0.6318
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Schistosoma mansoni amine GPCR 0.0107 0.0268 0.0241
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Leishmania major cathepsin L-like protease 0.0091 0.0209 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0107 0.0268 0.6312
Schistosoma mansoni alpha-1 adrenergic receptor 0.0107 0.0268 0.0241
Echinococcus multilocularis dro:myosuppressin receptor 0.0107 0.0268 0.0252
Leishmania major cathepsin L-like protease 0.0091 0.0209 1
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Plasmodium vivax vivapain-2 0.0091 0.0209 0.0169
Brugia malayi Serotonin receptor 0.0107 0.0268 0.6312
Echinococcus multilocularis cysteine protease 0.0091 0.0209 0.0193
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Brugia malayi neuropeptide F receptor 0.0107 0.0268 0.6312
Leishmania major cathepsin L-like protease 0.0091 0.0209 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0091 0.0209 0.0169
Schistosoma mansoni biogenic amine receptor 0.0107 0.0268 0.0241
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.006 0.0101 0.0074
Echinococcus multilocularis cysteine protease 0.0091 0.0209 0.0193
Echinococcus granulosus cathepsin L cysteine protease 0.0049 0.0062 0.0045
Onchocerca volvulus 0.0107 0.0268 1
Trypanosoma cruzi cysteine peptidase, putative 0.0091 0.0209 0.4179
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Onchocerca volvulus 0.0107 0.0268 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Echinococcus granulosus sex peptide receptor 0.0107 0.0268 0.0252
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0107 0.0268 0.0252
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0107 0.0268 0.6312
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0107 0.0268 0.6459
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.1581 0.5454 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0049 0.0062 0.0034
Onchocerca volvulus 0.0107 0.0268 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Echinococcus granulosus tachykinin peptides receptor 99D 0.0107 0.0268 0.0252
Echinococcus granulosus g protein coupled receptor 0.0107 0.0268 0.0252
Entamoeba histolytica cysteine proteinase, putative 0.0091 0.0209 1
Echinococcus granulosus hypothetical protein 0.0107 0.0268 0.0252
Trypanosoma cruzi cysteine peptidase, putative 0.0091 0.0209 0.4179
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Onchocerca volvulus 0.0107 0.0268 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus granulosus rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Echinococcus multilocularis orexin receptor type 2 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus multilocularis cathepsin b 0.0149 0.0415 0.0399
Onchocerca volvulus 0.0107 0.0268 1
Schistosoma mansoni neuropeptide f receptor 76f 0.0107 0.0268 0.0241
Onchocerca volvulus 0.0091 0.0209 0.6318
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Onchocerca volvulus Cathepsin F homolog 0.0091 0.0209 0.6318
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni neuropeptide F-like receptor 0.0107 0.0268 0.0241
Schistosoma mansoni amine GPCR 0.0107 0.0268 0.0241
Schistosoma mansoni myosin xvIII 0.0107 0.0268 0.0241
Onchocerca volvulus 0.0107 0.0268 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0107 0.0268 0.0252
Brugia malayi Cathepsin L-like precursor 0.0062 0.0109 0.2313
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Loa Loa (eye worm) fibroinase 0.0091 0.0209 0.5046
Echinococcus multilocularis G-protein coupled receptor, putative 0.0107 0.0268 0.0252
Echinococcus multilocularis cathepsin b 0.0149 0.0415 0.0399
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Plasmodium vivax dipeptidyl aminopeptidase 3, putative 0.0975 0.332 0.3723
Toxoplasma gondii preprocathepsin c precursor, putative 0.2536 0.8813 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0107 0.0268 0.0252
Brugia malayi ORL1-like opioid receptor 0.0107 0.0268 0.6312
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus multilocularis sex peptide receptor 0.0107 0.0268 0.0252
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0107 0.0268 0.0252
Trypanosoma brucei cysteine peptidase C (CPC) 0.006 0.0101 0.2691
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0062 0.0109 0.133
Schistosoma mansoni amine GPCR 0.0107 0.0268 0.0241
Echinococcus granulosus peptide allatostatin:somatostatin 0.0107 0.0268 0.0252
Echinococcus granulosus biogenic amine 5HT receptor 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Brugia malayi neuropeptide F receptor 0.0107 0.0268 0.6312
Schistosoma mansoni growth hormone secretagogue receptor 0.0107 0.0268 0.0241
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0107 0.0268 0.0241
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0107 0.0268 0.0252
Brugia malayi cathepsin B-like cysteine proteinase 0.0149 0.0415 1
Loa Loa (eye worm) cysteine protease 0.0091 0.0209 0.5046
Echinococcus granulosus neuropeptide FF receptor 2 0.0107 0.0268 0.0252
Echinococcus granulosus serotonin receptor 0.0107 0.0268 0.0252
Echinococcus multilocularis cathepsin L cysteine protease 0.0091 0.0209 0.0193
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Brugia malayi putative neuropeptide receptor 0.0107 0.0268 0.6312
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0107 0.0268 0.0241
Brugia malayi G protein-coupled receptor F59B2.13 0.0107 0.0268 0.6312
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Brugia malayi RE15519p 0.0107 0.0268 0.6312
Echinococcus multilocularis rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0107 0.0268 0.6312
Echinococcus multilocularis neuropeptides capa receptor 0.0107 0.0268 0.0252
Echinococcus granulosus g protein coupled receptor 0.0107 0.0268 0.0252
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0091 0.0209 0.0369
Echinococcus granulosus rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.2536 0.8813 0.8809
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0149 0.0415 0.0388
Leishmania major cathepsin L-like protease 0.0091 0.0209 1
Echinococcus multilocularis neuropeptide s receptor 0.0107 0.0268 0.0252
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Echinococcus granulosus cathepsin L cysteine proteinase 0.0091 0.0209 0.0193
Onchocerca volvulus 0.0107 0.0268 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0107 0.0268 0.0241
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Echinococcus multilocularis g-protein coupled receptor 0.0107 0.0268 0.0252
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Schistosoma mansoni neuropeptide F-like receptor 0.0107 0.0268 0.0241
Onchocerca volvulus 0.0091 0.0209 0.6318
Echinococcus granulosus fmrfamide receptor 0.0107 0.0268 0.0252
Onchocerca volvulus 0.0107 0.0268 1
Schistosoma mansoni opsin-like receptor 0.0107 0.0268 0.0241
Echinococcus granulosus cathepsin b 0.0149 0.0415 0.0399
Echinococcus multilocularis neuropeptide FF receptor 2 0.0107 0.0268 0.0252
Echinococcus granulosus rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Echinococcus multilocularis rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Echinococcus granulosus 7tm_1 domain containing protein 0.0107 0.0268 0.0252
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Leishmania major cathepsin L-like protease 0.0091 0.0209 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Entamoeba histolytica cysteine proteinase, putative 0.0062 0.0109 0.3182
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0107 0.0268 0.0252
Brugia malayi Cathepsin L-like cysteine proteinase 0.0062 0.0109 0.2313
Schistosoma mansoni opsin-like receptor 0.0107 0.0268 0.0241
Loa Loa (eye worm) G-protein coupled receptor 0.0107 0.0268 0.6459
Schistosoma mansoni hypothetical protein 0.0107 0.0268 0.0241
Onchocerca volvulus 0.0107 0.0268 1
Echinococcus granulosus cathepsin L 0.0049 0.0062 0.0045
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0107 0.0268 0.0241
Onchocerca volvulus 0.0107 0.0268 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Brugia malayi AKH receptor 0.0107 0.0268 0.6312
Echinococcus multilocularis neuropeptides capa receptor 0.0107 0.0268 0.0252
Schistosoma mansoni neuropeptide receptor 0.2873 1 1
Echinococcus granulosus cysteine protease 0.0049 0.0062 0.0045
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0107 0.0268 0.6459
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0107 0.0268 0.6312
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0049 0.0062 0.0034
Loa Loa (eye worm) G-protein coupled receptor 0.0107 0.0268 0.6459
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0091 0.0209 0.5046
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0062 0.0109 0.0184
Loa Loa (eye worm) hypothetical protein 0.0062 0.0109 0.262
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0107 0.0268 0.0241
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Onchocerca volvulus Neuropeptide F receptor homolog 0.0107 0.0268 1
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.006 0.0101 0.1125
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0091 0.0209 0.0369
Echinococcus granulosus somatostatin receptor 0.0107 0.0268 0.0252
Echinococcus multilocularis serotonin receptor 0.0107 0.0268 0.0252
Echinococcus granulosus neuropeptide Y receptor 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus granulosus alpha 1A adrenergic receptor 0.0107 0.0268 0.0252
Onchocerca volvulus 0.0107 0.0268 1
Brugia malayi Melatonin receptor type 1A 0.0107 0.0268 0.6312
Echinococcus granulosus rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Echinococcus granulosus neuropeptide Y receptor 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Plasmodium vivax dipeptidyl aminopeptidase 1, putative 0.2536 0.8813 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus granulosus 7TM GPCR rhodopsin 0.0107 0.0268 0.0252
Echinococcus granulosus cathepsin l1 0.0062 0.0109 0.0092
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni neuropeptide receptor 0.0107 0.0268 0.0241
Brugia malayi cathepsin L-like precursor 0.0062 0.0109 0.2313
Trypanosoma cruzi cysteine peptidase, putative 0.0091 0.0209 0.4179
Brugia malayi larval opioid receptor 0.0107 0.0268 0.6312
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0107 0.0268 0.0241
Echinococcus multilocularis neuropeptide receptor 0.2873 1 1
Echinococcus granulosus g protein coupled receptor 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Loa Loa (eye worm) hypothetical protein 0.0062 0.0109 0.262
Echinococcus granulosus neuropeptide s receptor 0.0107 0.0268 0.0252
Schistosoma mansoni adenoreceptor 0.0107 0.0268 0.0241
Echinococcus granulosus tm gpcr rhodopsin 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Schistosoma mansoni amine GPCR 0.0107 0.0268 0.0241
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Brugia malayi G protein-coupled receptor 0.0107 0.0268 0.6312
Echinococcus granulosus rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Plasmodium falciparum cysteine proteinase falcipain 3 0.0091 0.0209 0.0169
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0036 0.0017 0.04
Brugia malayi GnHR receptor homolog 0.0107 0.0268 0.6312
Onchocerca volvulus 0.0107 0.0268 1
Onchocerca volvulus 0.0107 0.0268 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0107 0.0268 0.0252
Echinococcus granulosus neuropeptides capa receptor 0.0107 0.0268 0.0252
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0091 0.0209 1
Echinococcus multilocularis g protein coupled receptor 0.0107 0.0268 0.0252
Trypanosoma cruzi cruzipain precursor, putative 0.0091 0.0209 0.4179
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0091 0.0209 0.5046
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0091 0.0209 0.0369
Echinococcus multilocularis g protein coupled receptor 0.0107 0.0268 0.0252
Toxoplasma gondii cathepsin CPC2 0.0975 0.332 0.3694
Echinococcus multilocularis neuropeptide receptor A26 0.0107 0.0268 0.0252
Brugia malayi hypothetical protein 0.0107 0.0268 0.6312
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Loa Loa (eye worm) melatonin receptor type 1A 0.0107 0.0268 0.6459
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0107 0.0268 0.0241
Leishmania major cysteine peptidase A (CPA) 0.0091 0.0209 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Giardia lamblia Encystation-specific protease 0.0975 0.332 0.3694
Brugia malayi Cathepsin L-like precursor 0.0091 0.0209 0.4839
Echinococcus multilocularis neuropeptide Y receptor 0.0107 0.0268 0.0252
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459
Echinococcus granulosus neuropeptides capa receptor 0.0107 0.0268 0.0252
Onchocerca volvulus 0.0091 0.0209 0.6318
Giardia lamblia Dipeptidyl-peptidase I precursor 0.2536 0.8813 1
Entamoeba histolytica cysteine proteinase, putative 0.0091 0.0209 1
Echinococcus granulosus neuropeptide receptor A26 0.0107 0.0268 0.0252
Brugia malayi Dopamine receptor protein 2 0.0107 0.0268 0.6312
Onchocerca volvulus 0.0091 0.0209 0.6318
Giardia lamblia Dipeptidyl-peptidase I precursor 0.0975 0.332 0.3694
Brugia malayi Serotonin receptor 0.0107 0.0268 0.6312
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0091 0.0209 0.0169
Echinococcus multilocularis fmrfamide receptor 0.0107 0.0268 0.0252
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0091 0.0209 0.0369
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0107 0.0268 0.0241
Brugia malayi Dopamine receptor protein 1 0.0107 0.0268 0.6312
Echinococcus multilocularis cathepsin L cysteine protease 0.0091 0.0209 0.0193
Echinococcus granulosus g-protein coupled receptor 0.0107 0.0268 0.0252
Echinococcus granulosus orexin receptor type 2 0.0107 0.0268 0.0252
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0107 0.0268 0.0252
Brugia malayi G-protein coupled receptor 0.0107 0.0268 0.6312
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0107 0.0268 0.0241
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0107 0.0268 0.0252
Echinococcus multilocularis G protein coupled receptor 139 0.2873 1 1
Plasmodium vivax vivapain-2 0.0091 0.0209 0.0169
Loa Loa (eye worm) hypothetical protein 0.0107 0.0268 0.6459

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.584 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.461 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference

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

No literature references available for this target.

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