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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

NameCHEMBL2068744
Molecular formulaC31H34N4O3
IUPAC name[4-(4-nitrophenyl)piperazin-1-yl]-[1-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)piperidin-2-yl]methanone
Molecular weight510.638
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP5.6
SynonymsSR-02000001251
SR-02000001251-1
Inchi KeyDCRSULWZBOQRND-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H34N4O3/c36-31(33-21-19-32(20-22-33)25-14-16-26(17-15-25)35(37)38)29-11-5-6-18-34(29)30-27-9-3-1-7-23(27)12-13-24-8-2-4-10-28(24)30/h1-4,7-10,14-17,29-30H,5-6,11-13,18-22H2
PubChem CID53234155
ChEMBLCHEMBL2068744
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
IC50<20000.0 nMPubChem BioAssay data setChEMBL

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