Reaction Details |
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Target | Cytochrome P450 2C19 |
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Ligand | BDBM50019652 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1361153 (CHEMBL3292127) |
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IC50 | >50000±n/a nM |
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Citation | Shirude, PS; Shandil, RK; Manjunatha, MR; Sadler, C; Panda, M; Panduga, V; Reddy, J; Saralaya, R; Nanduri, R; Ambady, A; Ravishankar, S; Sambandamurthy, VK; Humnabadkar, V; Jena, LK; Suresh, RS; Srivastava, A; Prabhakar, KR; Whiteaker, J; McLaughlin, RE; Sharma, S; Cooper, CB; Mdluli, K; Butler, S; Iyer, PS; Narayanan, S; Chatterji, M Lead optimization of 1,4-azaindoles as antimycobacterial agents. J Med Chem57:5728-37 (2014) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Cytochrome P450 2C19 |
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Name: | Cytochrome P450 2C19 |
Synonyms: | (R)-limonene 6-monooxygenase | (S)-limonene 6-monooxygenase | (S)-limonene 7-monooxygenase | CP2CJ_HUMAN | CYP2C19 | CYPIIC17 | CYPIIC19 | Cytochrome P450 2C19 (CYP2C19) | Cytochrome P450 2C19 [I331V] | Cytochrome P450-11A | Cytochrome P450-254C | Fenbendazole monooxygenase (4'-hydroxylating) | Mephenytoin 4-hydroxylase | P450-11A | P450-254C |
Type: | Enzyme |
Mol. Mass.: | 55935.47 |
Organism: | Homo sapiens (Human) |
Description: | P33261 |
Residue: | 490 |
Sequence: | MDPFVVLVLCLSCLLLLSIWRQSSGRGKLPPGPTPLPVIGNILQIDIKDVSKSLTNLSKI
YGPVFTLYFGLERMVVLHGYEVVKEALIDLGEEFSGRGHFPLAERANRGFGIVFSNGKRW
KEIRRFSLMTLRNFGMGKRSIEDRVQEEARCLVEELRKTKASPCDPTFILGCAPCNVICS
IIFQKRFDYKDQQFLNLMEKLNENIRIVSTPWIQICNNFPTIIDYFPGTHNKLLKNLAFM
ESDILEKVKEHQESMDINNPRDFIDCFLIKMEKEKQNQQSEFTIENLVITAADLLGAGTE
TTSTTLRYALLLLLKHPEVTAKVQEEIERVIGRNRSPCMQDRGHMPYTDAVVHEVQRYID
LIPTSLPHAVTCDVKFRNYLIPKGTTILTSLTSVLHDNKEFPNPEMFDPRHFLDEGGNFK
KSNYFMPFSAGKRICVGEGLARMELFLFLTFILQNFNLKSLIDPKDLDTTPVVNGFASVP
PFYQLCFIPV
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BDBM50019652 |
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n/a |
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Name | BDBM50019652 |
Synonyms: | CHEMBL3109801 |
Type | Small organic molecule |
Emp. Form. | C18H20FN5O2 |
Mol. Mass. | 357.3821 |
SMILES | COc1ncnc(Cn2cc(C(=O)NCCF)c3ncc(C)cc23)c1C |
Structure |
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