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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

NameBDBM61566
Molecular formulaC21H15FN4O2
IUPAC name4-[[[2-(2-fluorophenyl)quinazolin-4-yl]diazenyl]methyl]benzene-1,3-diol
Molecular weight374.375
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.6
Synonyms(4E)-4-[[N''-[2-(2-fluorophenyl)quinazolin-4-yl]hydrazino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one
(4E)-4-[[2-[2-(2-fluorophenyl)quinazolin-4-yl]hydrazinyl]methylidene]-3-hydroxycyclohexa-2,5-dien-1-one
(4E)-4-[[[2-(2-fluorophenyl)-4-quinazolinyl]hydrazo]methylidene]-3-hydroxy-1-cyclohexa-2,5-dienone
cid_16682714
(4E)-4-[[2-[2-(2-fluorophenyl)quinazolin-4-yl]hydrazinyl]methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one
Inchi KeyBDKQGMJNSVBBLT-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H15FN4O2/c22-17-7-3-1-5-15(17)20-24-18-8-4-2-6-16(18)21(25-20)26-23-12-13-9-10-14(27)11-19(13)28/h1-11,27-28H,12H2
PubChem CID91897479
ChEMBLN/A
IUPHARN/A
BindingDB61566
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC503078.12 nMN/ABindingDB

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