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GPCR

NameG-protein coupled receptor 35
SpeciesHomo sapiens (Human)
GeneGPR35
SynonymG-protein coupled receptor 3
GPR35
KYNA receptor
Kynurenic acid receptor
DiseaseN/A
Length309
Amino acid sequenceMNGTYNTCGSSDLTWPPAIKLGFYAYLGVLLVLGLLLNSLALWVFCCRMQQWTETRIYMTNLAVADLCLLCTLPFVLHSLRDTSDTPLCQLSQGIYLTNRYMSISLVTAIAVDRYVAVRHPLRARGLRSPRQAAAVCAVLWVLVIGSLVARWLLGIQEGGFCFRSTRHNFNSMAFPLLGFYLPLAVVVFCSLKVVTALAQRPPTDVGQAEATRKAARMVWANLLVFVVCFLPLHVGLTVRLAVGWNACALLETIRRALYITSKLSDANCCLDAICYYYMAKEFQEASALAVAPSAKAHKSQDSLCVTLA
UniProtQ9HC97
Protein Data BankN/A
GPCR-HGmod modelQ9HC97
3D structure modelThis predicted structure model is from GPCR-EXP Q9HC97.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL1293267
IUPHAR102
DrugBankBE0005562

Ligand

NameCHEMBL2392171
Molecular formulaC17H8BrCl2NO5
IUPAC name6-bromo-8-[(2,4-dichlorobenzoyl)amino]-4-oxochromene-2-carboxylic acid
Molecular weight457.057
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50436006
Inchi KeySARVDTIHXSLJDV-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H8BrCl2NO5/c18-7-3-10-13(22)6-14(17(24)25)26-15(10)12(4-7)21-16(23)9-2-1-8(19)5-11(9)20/h1-6H,(H,21,23)(H,24,25)
PubChem CID71733748
ChEMBLCHEMBL2392171
IUPHARN/A
BindingDB50436006
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC505.54 nMPMID23888932BindingDB
EC5016.0 nMPMID23713606BindingDB
EC5016.22 nMPMID23713606ChEMBL
EC5016.4 nMPMID23713606, PMID23888932ChEMBL
EC5034.6 nMPMID23713606ChEMBL
EC5035.0 nMPMID23713606BindingDB
Emax110.0 %PMID23713606ChEMBL
Emax116.0 %PMID23713606ChEMBL
Ki0.938 nMPMID23888932ChEMBL
Ki0.938 nMPMID23888932BindingDB

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