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Target
Cytochrome P450 2C9
Ligand
BDBM50254702
Substrate
n/a
Meas. Tech.
ChEMBL_560188 (CHEMBL1014601)
IC50
16000±n/a nM
Citation
 Mitchell, WL; Giblin, GM; Naylor, A; Eatherton, AJ; Slingsby, BP; Rawlings, AD; Jandu, KS; Haslam, CP; Brown, AJ; Goldsmith, P; Clayton, NM; Wilson, AW; Chessell, IP; Green, RH; Whittington, AR; Wall, ID Pyridine-3-carboxamides as novel CB(2) agonists for analgesia. Bioorg Med Chem Lett 19:259-63 (2008) [PubMed]  Article 
Target
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:
MDSLVVLVLCLSCLLLLSLWRQSSGRGKLPPGPTPLPVIGNILQIGIKDISKSLTNLSKVYGPVFTLYFGLKPIVVLHGYEAVKEALIDLGEEFSGRGIFPLAERANRGFGIVFSNGKKWKEIRRFSLMTLRNFGMGKRSIEDRVQEEARCLVEELRKTKASPCDPTFILGCAPCNVICSIIFHKRFDYKDQQFLNLMEKLNENIKILSSPWIQICNNFSPIIDYFPGTHNKLLKNVAFMKSYILEKVKEHQESMDMNNPQDFIDCFLMKMEKEKHNQPSEFTIESLENTAVDLFGAGTETTSTTLRYALLLLLKHPEVTAKVQEEIERVIGRNRSPCMQDRSHMPYTDAVVHEVQRYIDLLPTSLPHAVTCDIKFRNYLIPKGTTILISLTSVLHDNKEFPNPEMFDPHHFLDEGGNFKKSKYFMPFSAGKRICVGEALAGMELFLFLTSILQNFNLKSLVDPKNLDTTPVVNGFASVPPFYQLCFIPV
  
Inhibitor
Name:
BDBM50254702
Synonyms:
4-cyclopropyl-N-((tetrahydro-2H-pyran-4-yl)methyl)-6-(3-(trifluoromethoxy)phenylamino)nicotinamide | CHEMBL520413
Type:
Small organic molecule
Emp. Form.:
C22H24F3N3O3
Mol. Mass.:
435.4395
SMILES:
FC(F)(F)Oc1cccc(Nc2cc(C3CC3)c(cn2)C(=O)NCC2CCOCC2)c1
Structure:
Search PDB for entries with ligand similarity: