Reaction Details Report a problem with these data
Target
Nuclear receptor subfamily 1 group I member 3
Ligand
BDBM50525531
Substrate
n/a
Meas. Tech.
ChEMBL_1897372 (CHEMBL4399407)
EC50
990±n/a nM
Citation
 Liang, D; Li, L; Lynch, C; Diethelm-Varela, B; Xia, M; Xue, F; Wang, H DL5050, a Selective Agonist for the Human Constitutive Androstane Receptor. ACS Med Chem Lett 10:1039-1044 (2019) [PubMed]  Article 
Target
Name:
Nuclear receptor subfamily 1 group I member 3
Synonyms:
CAR | NR1I3 | NR1I3_HUMAN
Type:
PROTEIN
Mol. Mass.:
39953.17
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1434936
Residue:
352
Sequence:
MASREDELRNCVVCGDQATGYHFNALTCEGCKGFFRRTVSKSIGPTCPFAGSCEVSKTQRRHCPACRLQKCLDAGMRKDMILSAEALALRRAKQAQRRAQQTPVQLSKEQEELIRTLLGAHTRHMGTMFEQFVQFRPPAHLFIHHQPLPTLAPVLPLVTHFADINTFMVLQVIKFTKDLPVFRSLPIEDQISLLKGAAVEICHIVLNTTFCLQTQNFLCGPLRYTIEDGARVSPTVGFQVEFLELLFHFHGTLRKLQLQEPEYVLLAAMALFSPDRPGVTQRDEIDQLQEEMALTLQSYIKGQQRRPRDRFLYAKLLGLLAELRSINEAYGYQIQHIQGLSAMMPLLQEICS
  
Inhibitor
Name:
BDBM50525531
Synonyms:
CHEMBL4456609
Type:
Small organic molecule
Emp. Form.:
C23H16ClN3O2
Mol. Mass.:
401.845
SMILES:
Clc1ccc(CO\N=C\c2c(nc3occn23)-c2ccc3ccccc3c2)cc1
Structure:
Search PDB for entries with ligand similarity: