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Target
Cytochrome P450 1A2
Ligand
BDBM50448435
Substrate
n/a
Meas. Tech.
ChEMBL_1487340 (CHEMBL3535132)
Ki
13600±n/a nM
Citation
 Wattanachai, N; Tassaneeyakul, W; Rowland, A; Elliot, DJ; Bowalgaha, K; Knights, KM; Miners, JO Effect of albumin on human liver microsomal and recombinant CYP1A2 activities: impact on in vitro-in vivo extrapolation of drug clearance. Drug Metab Dispos 40:982-9 (2012) [PubMed]  Article 
Target
Name:
Cytochrome P450 1A2
Synonyms:
CP1A2_RAT | CYPIA2 | Cyp1a-2 | Cyp1a2 | Cytochrome P-448 | Cytochrome P-450d | Cytochrome P450-D
Type:
PROTEIN
Mol. Mass.:
58273.18
Organism:
Rattus norvegicus
Description:
ChEMBL_1487340
Residue:
513
Sequence:
MAFSQYISLAPELLLATAIFCLVFWVLRGTRTQVPKGLKSPPGPWGLPFIGHMLTLGKNPHLSLTKLSQQYGDVLQIRIGSTPVVVLSGLNTIKQALVKQGDDFKGRPDLYSFTLITNGKSMTFNPDSGPVWAARRRLAQDALKSFSIASDPTSVSSCYLEEHVSKEANHLISKFQKLMAEVGHFEPVNQVVESVANVIGAMCFGKNFPRKSEEMLNLVKSSKDFVENVTSGNAVDFFPVLRYLPNPALKRFKNFNDNFVLFLQKTVQEHYQDFNKNSIQDITGALFKHSENYKDNGGLIPQEKIVNIVNDIFGAGFETVTTAIFWSILLLVTEPKVQRKIHEELDTVIGRDRQPRLSDRPQLPYLEAFILEIYRYTSFVPFTIPHSTTRDTSLNGFHIPKECCIFINQWQVNHDEKQWKDPFVFRPERFLTNDNTAIDKTLSEKVMLFGLGKRRCIGEIPAKWEVFLFLAILLHQLEFTVPPGVKVDLTPSYGLTMKPRTCEHVQAWPRFSK
  
Inhibitor
Name:
BDBM50448435
Synonyms:
CHEMBL3122088
Type:
Small organic molecule
Emp. Form.:
C18H31O2
Mol. Mass.:
279.4381
SMILES:
CCCCC\C=C/C\C=C/CCCCCCCC([O-])=O
Structure:
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