Reaction Details Report a problem with these data
Target
Cytochrome P450 1A2
Ligand
BDBM50027784
Substrate
n/a
Meas. Tech.
ChEMBL_774163 (CHEMBL1908258)
Ki
30±n/a nM
Citation
 Fontana, E; Dansette, PM; Poli, SM Cytochrome p450 enzymes mechanism based inhibitors: common sub-structures and reactivity. Curr Drug Metab 6:413-54 (2005) [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:
BDBM50027784
Synonyms:
9-Ethynyl Phenanthrene | CHEMBL1908227
Type:
Small organic molecule
Emp. Form.:
C16H10
Mol. Mass.:
202.2506
SMILES:
C#Cc1cc2ccccc2c2ccccc12
Structure:
Search PDB for entries with ligand similarity: