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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

NameCHEMBL2392172
Molecular formulaC17H8BrCl2NO5
IUPAC name6-bromo-8-[(3,4-dichlorobenzoyl)amino]-4-oxochromene-2-carboxylic acid
Molecular weight457.057
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50436003
Inchi KeyYEAMBSPSKUHTDZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H8BrCl2NO5/c18-8-4-9-13(22)6-14(17(24)25)26-15(9)12(5-8)21-16(23)7-1-2-10(19)11(20)3-7/h1-6H,(H,21,23)(H,24,25)
PubChem CID71733749
ChEMBLCHEMBL2392172
IUPHARN/A
BindingDB50436003
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC5015.0 nMPMID23713606BindingDB
EC5015.4 nMPMID23713606ChEMBL
EC5015.49 nMPMID23713606ChEMBL
EC5025.0 nMPMID23888932BindingDB
EC5025.1 nMPMID23888932ChEMBL
EC5027.0 nMPMID23713606BindingDB
EC5027.2 nMPMID23713606ChEMBL
Emax109.0 %PMID23713606ChEMBL
Emax110.0 %PMID23713606ChEMBL
Ki2.18 nMPMID23888932ChEMBL
Ki2.2 nMPMID23888932BindingDB

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