Reaction Details Report a problem with these data
Target
G-protein coupled bile acid receptor 1
Ligand
BDBM50233502
Substrate
n/a
Meas. Tech.
ChEMBL_1650952 (CHEMBL4000086)
EC50
1510±n/a nM
Citation
 Zhang, X; Wall, M; Sui, Z; Kauffman, J; Hou, C; Chen, C; Du, F; Kirchner, T; Liang, Y; Johnson, DL; Murray, WV; Demarest, K Discovery of Orally Efficacious Tetrahydrobenzimidazoles as TGR5 Agonists for Type 2 Diabetes. ACS Med Chem Lett 8:560-565 (2017) [PubMed]  Article 
Target
Name:
G-protein coupled bile acid receptor 1
Synonyms:
GPBAR_MOUSE | Gpbar1 | M-BAR | Membrane-type receptor for bile acids | Tgr5
Type:
PROTEIN
Mol. Mass.:
35665.78
Organism:
Mus musculus
Description:
ChEMBL_1475560
Residue:
329
Sequence:
MMTPNSTELSAIPMGVLGLSLALASLIVIANLLLALGIALDRHLRSPPAGCFFLSLLLAGLLTGLALPMLPGLWSRNHQGYWSCLLLHLTPNFCFLSLLANLLLVHGERYMAVLQPLRPHGSVRLALFLTWVSSLFFASLPALGWNHWSPDANCSSQAVFPAPYLYLEVYGLLLPAVGATALLSVRVLATAHRQLCEIRRLERAVCRDVPSTLARALTWRQARAQAGATLLFLLCWGPYVATLLLSVLAYERRPPLGPGTLLSLISLGSTSAAAVPVAMGLGDQRYTAPWRTAAQRCLRVLRGRAKRDNPGPSTAYHTSSQCSIDLDLN
  
Inhibitor
Name:
BDBM50233502
Synonyms:
CHEMBL4069164
Type:
Small organic molecule
Emp. Form.:
C27H22Cl2F2N2OS
Mol. Mass.:
531.444
SMILES:
COc1ccc(cc1Cl)C1CCCc2nc(SCc3c(F)cccc3Cl)n(c12)-c1ccc(F)cc1
Structure:
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