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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

Namecid_655684
Molecular formulaC19H15Cl2N5
IUPAC name8-(2,3-dichlorophenyl)-6-imino-2-methyl-3,4,8,8a-tetrahydro-1H-isoquinoline-5,7,7-tricarbonitrile
Molecular weight384.264
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.7
Synonyms6-azanyl-8-[2,3-bis(chloranyl)phenyl]-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
BDBM34167
Inchi KeyFFGBLAHWAMEMLL-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H15Cl2N5/c1-26-6-5-11-13(7-22)18(25)19(9-23,10-24)16(14(11)8-26)12-3-2-4-15(20)17(12)21/h2-4,14,16,25H,5-6,8H2,1H3
PubChem CID91896197
ChEMBLN/A
IUPHARN/A
BindingDB34167
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC5012010.5 nMN/ABindingDB

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