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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

NameBDBM50437875
Molecular formulaC29H26N2O4
IUPAC name4-[4-[(1R)-3-(1-methyl-6-oxopyridin-3-yl)-1-(2-methylphenyl)-3-nitrosopropyl]phenyl]benzoic acid
Molecular weight466.537
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.6
SynonymsN/A
Inchi KeyANOSMWHBNFJLHV-AVJYQCBHSA-N
Inchi IDInChI=1S/C29H26N2O4/c1-19-5-3-4-6-25(19)26(17-27(30-35)24-15-16-28(32)31(2)18-24)22-11-7-20(8-12-22)21-9-13-23(14-10-21)29(33)34/h3-16,18,26-27H,17H2,1-2H3,(H,33,34)/t26-,27?/m1/s1
PubChem CID91898722
ChEMBLN/A
IUPHARN/A
BindingDB50437875
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
EC50450.0 nMPMID23831134BindingDB

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