Detailed information for compound 1466633

Basic information

Technical information
  • TDR Targets ID: 1466633
  • Name: 7-methyl-4-(3-pyridin-4-ylphenyl)-8-(trifluor omethyl)-1,3-dihydro-1,5-benzodiazepin-2-one
  • MW: 395.377 | Formula: C22H16F3N3O
  • H donors: 1 H acceptors: 2 LogP: 4.22 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1CC(=Nc2c(N1)cc(c(c2)C)C(F)(F)F)c1cccc(c1)c1ccncc1
  • InChi: 1S/C22H16F3N3O/c1-13-9-19-20(11-17(13)22(23,24)25)28-21(29)12-18(27-19)16-4-2-3-15(10-16)14-5-7-26-8-6-14/h2-11H,12H2,1H3,(H,28,29)
  • InChiKey: ZYGZDPKEZBLAHD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 7-methyl-4-[3-(4-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cytochrome P450, family 3, subfamily A, polypeptide 4 Starlite/ChEMBL References
Rattus norvegicus Metabotropic glutamate receptor 2 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma brucei cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma cruzi cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma japonicum Metabotropic glutamate receptor precursor, putative Get druggable targets OG5_127095 All targets in OG5_127095
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Loa Loa (eye worm) CYP4Cod1 Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11 Get druggable targets OG5_126554 All targets in OG5_126554
Echinococcus granulosus metabotropic glutamate receptor 2 Get druggable targets OG5_127095 All targets in OG5_127095
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127095 All targets in OG5_127095
Loa Loa (eye worm) glutamate receptor Get druggable targets OG5_127095 All targets in OG5_127095
Leishmania donovani cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans cytochrome P450 56 Get druggable targets OG5_126554 All targets in OG5_126554
Echinococcus multilocularis metabotropic glutamate receptor 2 Get druggable targets OG5_127095 All targets in OG5_127095
Leishmania infantum cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma mansoni metabotropic glutamate receptor Get druggable targets OG5_127095 All targets in OG5_127095
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative Get druggable targets OG5_127095 All targets in OG5_127095
Candida albicans cytochrome P450 556 Get druggable targets OG5_126554 All targets in OG5_126554
Brugia malayi Metabotropic glutamate receptor precursor. Get druggable targets OG5_127095 All targets in OG5_127095
Candida albicans closely related to C.maltosa N-alkane-inducible cytochrome P-450, alkane hydroxylating monooxygenase CYP52A3-b aka P450Alk1A (BA Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma congolense cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Echinococcus multilocularis metabotropic glutamate receptor 5 Get druggable targets OG5_127095 All targets in OG5_127095
Trypanosoma cruzi cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania major cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma brucei gambiense cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11 Get druggable targets OG5_126554 All targets in OG5_126554
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma japonicum hypothetical protein Get druggable targets OG5_127095 All targets in OG5_127095
Leishmania braziliensis cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Echinococcus granulosus metabotropic glutamate receptor 5 Get druggable targets OG5_127095 All targets in OG5_127095
Schistosoma japonicum ko:K04606 glutamate receptor, metabotropic 3, putative Get druggable targets OG5_127095 All targets in OG5_127095
Leishmania mexicana cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) Get druggable targets OG5_127095 All targets in OG5_127095
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Onchocerca volvulus Cell death abnormality protein 8 homolog Metabotropic glutamate receptor 2   872 aa 883 aa 43.3 %
Loa Loa (eye worm) hypothetical protein Metabotropic glutamate receptor 2   872 aa 822 aa 21.2 %
Onchocerca volvulus Metabotropic glutamate receptor 2   872 aa 774 aa 20.4 %
Brugia malayi cytochrome P450 cytochrome P450, family 3, subfamily A, polypeptide 4 502 aa 492 aa 24.2 %
Schistosoma mansoni metabotropic glutamate receptor Metabotropic glutamate receptor 2   872 aa 892 aa 26.9 %
Onchocerca volvulus Golgi-associated plant pathogenesis-related protein 1 homolog Metabotropic glutamate receptor 2   872 aa 884 aa 35.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Giardia lamblia Aldose reductase 0.0363 0.1325 1
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0106 0.0322 0.096
Mycobacterium ulcerans undecapaprenyl-phosphate alpha-N-acetylglucosaminyltransferase Rfe 0.0108 0.033 0.0013
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0363 0.1325 0.1041
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0106 0.0322 0.1284
Toxoplasma gondii aldose reductase, putative 0.0363 0.1325 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0106 0.0322 0.1284
Echinococcus granulosus hypothetical protein 0.0363 0.1325 0.5413
Loa Loa (eye worm) serotonin transporter b 0.0627 0.2357 1
Loa Loa (eye worm) hypothetical protein 0.0627 0.2357 1
Mycobacterium leprae Conserved hypothetical protein 0.0258 0.0914 0.0616
Loa Loa (eye worm) hypothetical protein 0.0106 0.0322 0.1367
Brugia malayi Metabotropic glutamate receptor precursor. 0.0061 0.0145 0.0524
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Trypanosoma brucei aldo-keto reductase, putative 0.0363 0.1325 1
Echinococcus granulosus aldo keto reductase 0.0363 0.1325 0.5413
Loa Loa (eye worm) hypothetical protein 0.0106 0.0322 0.1367
Echinococcus multilocularis UDP N acetylglucosamine dolichyl phosphate 0.0108 0.033 0.0994
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0106 0.0322 0.096
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Mycobacterium tuberculosis Probable oxidoreductase 0.0363 0.1325 0.1041
Mycobacterium ulcerans oxidoreductase 0.0363 0.1325 0.1041
Loa Loa (eye worm) hypothetical protein 0.0106 0.0322 0.1367
Onchocerca volvulus 0.0363 0.1325 0.4939
Echinococcus multilocularis voltage gated potassium channel subunit 0.0105 0.0317 0.0937
Echinococcus multilocularis aldo keto reductase 0.0363 0.1325 0.5413
Echinococcus granulosus serotonin transporter 0.0627 0.2357 1
Onchocerca volvulus 0.0106 0.0322 0.0025
Plasmodium falciparum UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0108 0.033 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Trypanosoma cruzi UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0108 0.033 0.0128
Schistosoma mansoni potassium channel beta 0.0105 0.0317 0.1261
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Loa Loa (eye worm) hypothetical protein 0.0106 0.0322 0.1367
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0105 0.0317 0.0937
Entamoeba histolytica aldose reductase, putative 0.0363 0.1325 1
Loa Loa (eye worm) oxidoreductase 0.0363 0.1325 0.562
Schistosoma mansoni sodium-dependent amino acid transporter 0.0106 0.0322 0.1284
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0106 0.0322 0.096
Brugia malayi UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase 0.0108 0.033 0.1317
Echinococcus granulosus sodium and chloride dependent glycine 0.0106 0.0322 0.096
Onchocerca volvulus 0.0363 0.1325 0.4939
Schistosoma mansoni sodium/chloride dependent transporter 0.0106 0.0322 0.1284
Leishmania major UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0108 0.033 0.0128
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0055 0.0122 0.0428
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0106 0.0322 0.1367
Schistosoma mansoni metabotropic glutamate receptor 0.0051 0.0106 0.0358
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0069 0.0178 0.0665
Onchocerca volvulus 0.0363 0.1325 0.4939
Onchocerca volvulus 0.0108 0.033 0.0063
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Echinococcus multilocularis serotonin transporter 0.0627 0.2357 1
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0363 0.1325 1
Leishmania major aldo-keto reductase-like protein 0.0363 0.1325 1
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0106 0.0322 0.096
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0363 0.1325 0.5578
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0075 0.02 0.0417
Loa Loa (eye worm) norepinephrine transporter 0.0627 0.2357 1
Trypanosoma brucei prostaglandin f synthase 0.0363 0.1325 1
Schistosoma mansoni pol-related 0.0363 0.1325 0.5578
Echinococcus multilocularis aldo keto reductase 0.0363 0.1325 0.5413
Trypanosoma brucei UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0108 0.033 0.0128
Leishmania major prostaglandin f synthase, putative 0.0363 0.1325 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.02 0.0849
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0106 0.0322 0.1284
Onchocerca volvulus 0.0627 0.2357 1
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0105 0.0317 0.1345
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Plasmodium vivax N-acetylglucosamine-1-phosphate transferase, putative 0.0108 0.033 1
Toxoplasma gondii glycosyl transferase, group 4 family protein 0.0108 0.033 0.0128
Loa Loa (eye worm) hypothetical protein 0.0627 0.2357 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0106 0.0322 0.1284
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0106 0.0322 0.1284
Toxoplasma gondii hypothetical protein 0.0106 0.0322 0.0051
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0106 0.0322 0.1367
Trypanosoma cruzi UDP-N-acetylglucosamine-dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0108 0.033 0.0128
Brugia malayi hypothetical protein 0.0106 0.0322 0.1284
Entamoeba histolytica aldose reductase, putative 0.0363 0.1325 1
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0106 0.0322 0.096
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0363 0.1325 0.5578
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Loa Loa (eye worm) hypothetical protein 0.0106 0.0322 0.1367
Plasmodium vivax amine transporter, putative 0.0106 0.0322 0.4007
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0363 0.1325 1
Trypanosoma cruzi aldo/keto reductase, putative 0.0363 0.1325 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0106 0.0322 0.1284
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0363 0.1325 1
Onchocerca volvulus 0.0106 0.0322 0.0025
Schistosoma mansoni aldo-keto reductase 0.0363 0.1325 0.5578
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Echinococcus granulosus sodium and chloride dependent glycine 0.0106 0.0322 0.096
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Loa Loa (eye worm) hypothetical protein 0.0627 0.2357 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Plasmodium falciparum amino acid transporter, putative 0.0106 0.0322 0.4007
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0106 0.0322 0.1284
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0106 0.0322 0.1284
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0106 0.0322 0.1284
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0105 0.0317 0.1261
Entamoeba histolytica UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase, putative 0.0108 0.033 0.0128
Wolbachia endosymbiont of Brugia malayi phospho-N-acetylmuramoyl-pentapeptide-transferase 0.2583 1 0.5
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0627 0.2357 1
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0106 0.0322 0.1284
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Treponema pallidum phospho-N-acetylmuramoyl-pentapeptide-transferase (mraY) 0.0982 0.3743 1
Schistosoma mansoni UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase 0.0108 0.033 0.1317
Toxoplasma gondii hypothetical protein 0.0106 0.0322 0.0051
Schistosoma mansoni UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase 0.0108 0.033 0.1317
Onchocerca volvulus 0.0106 0.0322 0.0025
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0627 0.2357 1
Echinococcus granulosus aldehyde reductase 0.0258 0.0914 0.3588
Schistosoma mansoni sodium/chloride dependent transporter 0.0627 0.2357 1
Plasmodium vivax hypothetical protein, conserved 0.0106 0.0322 0.4007
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Entamoeba histolytica aldose reductase, putative 0.0363 0.1325 1
Chlamydia trachomatis phospho-N-acetylmuramoyl-pentapeptide-transferase 0.0982 0.3743 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0363 0.1325 0.5578
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Echinococcus multilocularis aldehyde reductase 0.0258 0.0914 0.3588
Loa Loa (eye worm) hypothetical protein 0.0106 0.0322 0.1367
Onchocerca volvulus 0.0363 0.1325 0.4939
Echinococcus multilocularis aldo keto reductase 0.0363 0.1325 0.5413
Brugia malayi NADH-dependent xylose reductase 0.0105 0.0317 0.1261
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Trichomonas vaginalis aldo/keto reductase, putative 0.0363 0.1325 1
Echinococcus granulosus aldo keto reductase 0.0363 0.1325 0.5413
Trypanosoma cruzi aldo-keto reductase 0.0363 0.1325 1
Mycobacterium tuberculosis Probable phospho-N-acetylmuramoyl-pentappeptidetransferase MurX 0.2583 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Trichomonas vaginalis glucosaminephosphotransferase, putative 0.0108 0.033 0.0128
Echinococcus granulosus UDP N acetylglucosamine dolichyl phosphate 0.0108 0.033 0.0994
Echinococcus granulosus metabotropic glutamate receptor 5 0.0075 0.02 0.0417
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0363 0.1325 0.5413
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0363 0.1325 0.5578
Trichomonas vaginalis aldo/keto reductase, putative 0.0363 0.1325 1
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0363 0.1325 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Loa Loa (eye worm) oxidoreductase 0.0363 0.1325 0.562
Schistosoma mansoni aldo-keto reductase 0.0363 0.1325 0.5578
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0106 0.0322 0.0051
Echinococcus multilocularis sodium and chloride dependent glycine 0.0106 0.0322 0.096
Schistosoma mansoni sodium/chloride dependent transporter 0.0106 0.0322 0.1284
Loa Loa (eye worm) hypothetical protein 0.0108 0.033 0.1399
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0106 0.0322 0.1284
Echinococcus granulosus aldo keto reductase 0.0363 0.1325 0.5413
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0106 0.0322 0.1284
Plasmodium falciparum transporter, putative 0.0106 0.0322 0.4007
Loa Loa (eye worm) solute carrier family 6 member 4 0.0627 0.2357 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0106 0.0322 0.0051
Loa Loa (eye worm) glutamate receptor 0.0061 0.0145 0.0615
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0106 0.0322 0.096
Echinococcus multilocularis sodium and chloride dependent glycine 0.0106 0.0322 0.096
Loa Loa (eye worm) oxidoreductase 0.0363 0.1325 0.562
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0363 0.1325 0.5413
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Onchocerca volvulus 0.0363 0.1325 0.4939
Loa Loa (eye worm) hypothetical protein 0.0363 0.1325 0.562
Loa Loa (eye worm) oxidoreductase 0.0363 0.1325 0.562
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Echinococcus multilocularis aldo keto reductase 0.0363 0.1325 0.5413
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0363 0.1325 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.0322 0.1367
Trichomonas vaginalis aldo/keto reductase, putative 0.0363 0.1325 1
Echinococcus granulosus voltage gated potassium channel subunit 0.0105 0.0317 0.0937
Onchocerca volvulus 0.0363 0.1325 0.4939
Mycobacterium ulcerans phospho-N-acetylmuramoyl-pentapeptide-transferase 0.2583 1 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0106 0.0322 0.0051
Loa Loa (eye worm) oxidoreductase 0.0363 0.1325 0.562
Giardia lamblia Aldose reductase 0.0363 0.1325 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0363 0.1325 1
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0106 0.0322 0.096

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.004 uM Partial displacement of [3H]LY354740 from recombinant rat mGluR2 ChEMBL. 20971004
IC50 (functional) = 0.011 uM Antagonist activity at recombinant rat mGluR2 expressed in forskolin-stimulated CHO cells assessed as inhibition of (1S,3R)-ACPD induced cAMP production ChEMBL. 20971004
IC50 (ADMET) = 0.2 uM Inhibition of CYP3A4 ChEMBL. 20971004

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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