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GPCR

NameNeuropeptides B/W receptor type 1
SpeciesHomo sapiens (Human)
GeneNPBWR1
SynonymG protein-coupled receptor 7
G-protein coupled receptor 7
GPR7
neuropeptides B/W receptor type 1
NPBW1 receptor
DiseaseN/A
Length328
Amino acid sequenceMDNASFSEPWPANASGPDPALSCSNASTLAPLPAPLAVAVPVVYAVICAVGLAGNSAVLYVLLRAPRMKTVTNLFILNLAIADELFTLVLPINIADFLLRQWPFGELMCKLIVAIDQYNTFSSLYFLTVMSADRYLVVLATAESRRVAGRTYSAARAVSLAVWGIVTLVVLPFAVFARLDDEQGRRQCVLVFPQPEAFWWRASRLYTLVLGFAIPVSTICVLYTTLLCRLHAMRLDSHAKALERAKKRVTFLVVAILAVCLLCWTPYHLSTVVALTTDLPQTPLVIAISYFITSLSYANSCLNPFLYAFLDASFRRNLRQLITCRAAA
UniProtP48145
Protein Data BankN/A
GPCR-HGmod modelP48145
3D structure modelThis predicted structure model is from GPCR-EXP P48145.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL1293293
IUPHARN/A
DrugBankN/A

Ligand

NameSR-02000000355
Molecular formulaC20H19ClN2O3
IUPAC name5-chloro-4-[4-(hydroxymethyl)phenoxy]-2-(4-propan-2-ylphenyl)pyridazin-3-one
Molecular weight370.833
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.8
Synonyms5-chloro-4-[4-(hydroxymethyl)phenoxy]-2-(4-propan-2-ylphenyl)pyridazin-3-one
SR-02000000355-2
5-chloro-4-(4-methylolphenoxy)-2-p-cumenyl-pyridazin-3-one
SR-02000000355-3
CHEMBL1710128
[ Show all ]
Inchi KeyBRSNXYWTPOJCCY-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19ClN2O3/c1-13(2)15-5-7-16(8-6-15)23-20(25)19(18(21)11-22-23)26-17-9-3-14(12-24)4-10-17/h3-11,13,24H,12H2,1-2H3
PubChem CID46172918
ChEMBLCHEMBL1710128
IUPHARN/A
BindingDB75887
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50650.0 nM, PubChem BioAssay data set, PMID23079522BindingDB,ChEMBL

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