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GPCR

NameHydroxycarboxylic acid receptor 3
SpeciesHomo sapiens (Human)
GeneHCAR3
SynonymG-protein coupled receptor 109B
Nicotinic acid receptor 2
Nic2
NIACR2
Niacin receptor 2
[ Show all ]
DiseaseN/A
Length387
Amino acid sequenceMNRHHLQDHFLEIDKKNCCVFRDDFIAKVLPPVLGLEFIFGLLGNGLALWIFCFHLKSWKSSRIFLFNLAVADFLLIICLPFVMDYYVRRSDWKFGDIPCRLVLFMFAMNRQGSIIFLTVVAVDRYFRVVHPHHALNKISNWTAAIISCLLWGITVGLTVHLLKKKLLIQNGTANVCISFSICHTFRWHEAMFLLEFFLPLGIILFCSARIIWSLRQRQMDRHAKIKRAITFIMVVAIVFVICFLPSVVVRIHIFWLLHTSGTQNCEVYRSVDLAFFITLSFTYMNSMLDPVVYYFSSPSFPNFFSTLINRCLQRKITGEPDNNRSTSVELTGDPNKTRGAPEALIANSGEPWSPSYLGPTSNNHSKKGHCHQEPASLEKQLGCCIE
UniProtP49019
Protein Data BankN/A
GPCR-HGmod modelP49019
3D structure modelThis predicted structure model is from GPCR-EXP P49019.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4421
IUPHAR313
DrugBankBE0000836

Ligand

NameCHEMBL375754
Molecular formulaC11H12O4
IUPAC name5-(cyclopenten-1-yl)-5-methyl-4-oxofuran-2-carboxylic acid
Molecular weight208.213
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP1.2
SynonymsBDBM50208112
SCHEMBL3098475
5-cyclopent-1-enyl-5-methyl-4-oxo-4,5-dihydro-furan-2-carboxylic acid
Inchi KeyLDRXFNRHMPVZBO-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H12O4/c1-11(7-4-2-3-5-7)9(12)6-8(15-11)10(13)14/h4,6H,2-3,5H2,1H3,(H,13,14)
PubChem CID11413114
ChEMBLCHEMBL375754
IUPHARN/A
BindingDB50208112
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC505100.0 nMPMID17358052BindingDB,ChEMBL

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