Reaction Details Report a problem with these data
Target
Cytochrome P450 2C8
Ligand
BDBM50520561
Substrate
n/a
Meas. Tech.
ChEMBL_1880728 (CHEMBL4382122)
IC50
>200000±n/a nM
Citation
 Chen, W; Yuan, X; Li, Z; Lu, Z; Kong, S; Jiang, H; Du, H; Pan, X; Nandi, M; Kong, X; Brown, K; Liu, Z; Zhang, G; Hider, RC; Yu, Y CN128: A New Orally Active Hydroxypyridinone Iron Chelator. J Med Chem 63:4215-4226 (2020) [PubMed]  Article 
Target
Name:
Cytochrome P450 2C8
Synonyms:
CP2C8_HUMAN | CYP2C8 | CYPIIC8 | Cytochrome P450 2C8 (CYP2C8) | P450 IIC2 | P450 MP-12/MP-20 | P450 form 1 | S-mephenytoin 4-hydroxylase
Type:
Protein
Mol. Mass.:
55839.23
Organism:
Homo sapiens (Human)
Description:
P10632
Residue:
490
Sequence:
MEPFVVLVLCLSFMLLFSLWRQSCRRRKLPPGPTPLPIIGNMLQIDVKDICKSFTNFSKVYGPVFTVYFGMNPIVVFHGYEAVKEALIDNGEEFSGRGNSPISQRITKGLGIISSNGKRWKEIRRFSLTTLRNFGMGKRSIEDRVQEEAHCLVEELRKTKASPCDPTFILGCAPCNVICSVVFQKRFDYKDQNFLTLMKRFNENFRILNSPWIQVCNNFPLLIDCFPGTHNKVLKNVALTRSYIREKVKEHQASLDVNNPRDFIDCFLIKMEQEKDNQKSEFNIENLVGTVADLFVAGTETTSTTLRYGLLLLLKHPEVTAKVQEEIDHVIGRHRSPCMQDRSHMPYTDAVVHEIQRYSDLVPTGVPHAVTTDTKFRNYLIPKGTTIMALLTSVLHDDKEFPNPNIFDPGHFLDKNGNFKKSDYFMPFSAGKRICAGEGLARMELFLFLTTILQNFNLKSVDDLKNLNTTAVTKGIVSLPPSYQICFIPV
  
Inhibitor
Name:
BDBM50520561
Synonyms:
CHEMBL4467408
Type:
Small organic molecule
Emp. Form.:
C15H18ClNO3
Mol. Mass.:
295.761
SMILES:
[Cl-].Cc1c(O)c(O)cc[n+]1[C@@H](CO)Cc1ccccc1 |r|
Structure:
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