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GPCR

NameG-protein coupled bile acid receptor 1
SpeciesMus musculus (Mouse)
GeneGpbar1
Synonymmembrane-type receptor for bile acids
M-BAR
hGPCR19
GPR131
GPCR19
[ Show all ]
DiseaseN/A for non-human GPCRs
Length329
Amino acid sequenceMMTPNSTELSAIPMGVLGLSLALASLIVIANLLLALGIALDRHLRSPPAGCFFLSLLLAGLLTGLALPMLPGLWSRNHQGYWSCLLLHLTPNFCFLSLLANLLLVHGERYMAVLQPLRPHGSVRLALFLTWVSSLFFASLPALGWNHWSPDANCSSQAVFPAPYLYLEVYGLLLPAVGATALLSVRVLATAHRQLCEIRRLERAVCRDVPSTLARALTWRQARAQAGATLLFLLCWGPYVATLLLSVLAYERRPPLGPGTLLSLISLGSTSAAAVPVAMGLGDQRYTAPWRTAAQRCLRVLRGRAKRDNPGPSTAYHTSSQCSIDLDLN
UniProtQ80SS6
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL1255150
IUPHAR37
DrugBankN/A

Ligand

NameCHEMBL1257259
Molecular formulaC22H18BrClN2S
IUPAC name2-(4-bromophenyl)-N-[(7-chloro-2-thiophen-3-ylquinolin-3-yl)methyl]ethanamine
Molecular weight457.814
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP6.2
SynonymsBDBM50327533
SCHEMBL4741389
2-(4-bromophenyl)-n-((7-chloro-2-(thiophen-3-yl)quinolin-3-yl)methyl)ethanamine
Inchi KeyDUVQVRXNQLSYLB-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H18BrClN2S/c23-19-4-1-15(2-5-19)7-9-25-13-18-11-16-3-6-20(24)12-21(16)26-22(18)17-8-10-27-14-17/h1-6,8,10-12,14,25H,7,9,13H2
PubChem CID52941296
ChEMBLCHEMBL1257259
IUPHARN/A
BindingDB50327533
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
IC50<10000.0 nMPMID20801037BindingDB,ChEMBL

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