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TargetCytochrome P450 2C9
LigandBDBM50575474
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2125319 (CHEMBL4834664)
IC50>20000±n/a nM
Citation Markert, CThoma, GSrinivas, HBollbuck, BLüönd, RMMiltz, WWälchli, RWolf, RHinrichs, JBergsdorf, CAzzaoui, KPenno, CAKlein, KWack, NJäger, PHasler, FBeerli, CLoetscher, PDawson, JWieczorek, GNumao, SLittlewood-Evans, ARöhn, TA Discovery of LYS006, a Potent and Highly Selective Inhibitor of Leukotriene A J Med Chem64:1889-1903 (2021) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cytochrome P450 2C9
Name:Cytochrome P450 2C9
Synonyms:(R)-limonene 6-monooxygenase | (S)-limonene 6-monooxygenase | CP2C9_HUMAN | CYP2C10 | CYP2C9 | CYPIIC9 | Cytochrome P450 2C9 (CYP2C9 ) | Cytochrome P450 2C9 (CYP2C9) | P-450MP | P450 MP-4/MP-8 | P450 PB-1 | S-mephenytoin 4-hydroxylase
Type:Enzyme
Mol. Mass.:55636.33
Organism:Homo sapiens (Human)
Description:P11712
Residue:490
Sequence:
MDSLVVLVLCLSCLLLLSLWRQSSGRGKLPPGPTPLPVIGNILQIGIKDISKSLTNLSKV
YGPVFTLYFGLKPIVVLHGYEAVKEALIDLGEEFSGRGIFPLAERANRGFGIVFSNGKKW
KEIRRFSLMTLRNFGMGKRSIEDRVQEEARCLVEELRKTKASPCDPTFILGCAPCNVICS
IIFHKRFDYKDQQFLNLMEKLNENIKILSSPWIQICNNFSPIIDYFPGTHNKLLKNVAFM
KSYILEKVKEHQESMDMNNPQDFIDCFLMKMEKEKHNQPSEFTIESLENTAVDLFGAGTE
TTSTTLRYALLLLLKHPEVTAKVQEEIERVIGRNRSPCMQDRSHMPYTDAVVHEVQRYID
LLPTSLPHAVTCDIKFRNYLIPKGTTILISLTSVLHDNKEFPNPEMFDPHHFLDEGGNFK
KSKYFMPFSAGKRICVGEALAGMELFLFLTSILQNFNLKSLVDPKNLDTTPVVNGFASVP
PFYQLCFIPV
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  Blast E-value cutoff:
BDBM50575474
n/a
NameBDBM50575474
Synonyms:CHEMBL4877514
TypeSmall organic molecule
Emp. Form.C16H13ClN4O3
Mol. Mass.344.752
SMILESOC(=O)CCn1nnc(n1)-c1ccc(Oc2ccc(Cl)cc2)cc1
Structure
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