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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

NameCHEMBL3297873
Molecular formulaC19H20N2O3
IUPAC name2-(3-quinolin-6-ylpropanoylamino)cyclohexene-1-carboxylic acid
Molecular weight324.38
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.1
SynonymsN/A
Inchi KeyKHTVMFJCMFWFBJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H20N2O3/c22-18(21-17-6-2-1-5-15(17)19(23)24)10-8-13-7-9-16-14(12-13)4-3-11-20-16/h3-4,7,9,11-12H,1-2,5-6,8,10H2,(H,21,22)(H,23,24)
PubChem CID90682801
ChEMBLCHEMBL3297873
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Inhibition60.0 %PMID24864041ChEMBL

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