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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

NameMLS001225295
Molecular formulaC24H27N5O5S
IUPAC name4-amino-5-N-[2-(cyclohexylamino)-1-(furan-2-yl)-2-oxoethyl]-5-N-(2-methoxyphenyl)-1,2-thiazole-3,5-dicarboxamide
Molecular weight497.57
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP3.3
Synonyms4-azanyl-N5-[2-(cyclohexylamino)-1-(furan-2-yl)-2-oxidanylidene-ethyl]-N5-(2-methoxyphenyl)-1,2-thiazole-3,5-dicarboxamide
CHEMBL1388042
AKOS000797724
4-amino-N''-[2-(cyclohexylamino)-1-(2-furyl)-2-keto-ethyl]-N''-(2-methoxyphenyl)isothiazole-3,5-dicarboxamide
BDBM62160
[ Show all ]
Inchi KeyAJIYPQQWLOFUGX-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H27N5O5S/c1-33-16-11-6-5-10-15(16)29(24(32)21-18(25)19(22(26)30)28-35-21)20(17-12-7-13-34-17)23(31)27-14-8-3-2-4-9-14/h5-7,10-14,20H,2-4,8-9,25H2,1H3,(H2,26,30)(H,27,31)
PubChem CID3180687
ChEMBLCHEMBL1388042
IUPHARN/A
BindingDB62160
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50<43807.0 nMPubChem BioAssay data setChEMBL
IC5043807.0 nMN/ABindingDB

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