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GPCR

NameGastrin/cholecystokinin type B receptor
SpeciesHomo sapiens (Human)
GeneCCKBR
SynonymCCK-B receptor
CCK-B receptor {ECO:0000303|PubMed:8415658}
CCK-B/gastrin receptor
CCK-BR
gastrin/cholecystokinin type B receptor
[ Show all ]
DiseaseDiagnostic imaging
Duodenal ulcers
Gastroesophageal reflux disease
Gastrointestinal disease
Intestine cancer
[ Show all ]
Length447
Amino acid sequenceMELLKLNRSVQGTGPGPGASLCRPGAPLLNSSSVGNLSCEPPRIRGAGTRELELAIRITLYAVIFLMSVGGNMLIIVVLGLSRRLRTVTNAFLLSLAVSDLLLAVACMPFTLLPNLMGTFIFGTVICKAVSYLMGVSVSVSTLSLVAIALERYSAICRPLQARVWQTRSHAARVIVATWLLSGLLMVPYPVYTVVQPVGPRVLQCVHRWPSARVRQTWSVLLLLLLFFIPGVVMAVAYGLISRELYLGLRFDGDSDSDSQSRVRNQGGLPGAVHQNGRCRPETGAVGEDSDGCYVQLPRSRPALELTALTAPGPGSGSRPTQAKLLAKKRVVRMLLVIVVLFFLCWLPVYSANTWRAFDGPGAHRALSGAPISFIHLLSYASACVNPLVYCFMHRRFRQACLETCARCCPRPPRARPRALPDEDPPTPSIASLSRLSYTTISTLGPG
UniProtP32239
Protein Data BankN/A
GPCR-HGmod modelP32239
3D structure modelThis predicted structure model is from GPCR-EXP P32239.
BioLiPN/A
Therapeutic Target DatabaseT05849
ChEMBLCHEMBL298
IUPHAR77
DrugBankBE0001158

Ligand

NameCHEMBL332595
Molecular formulaC28H30N4O3
IUPAC name1-[5-(4-methylpentan-2-yl)-2,4-dioxo-1-phenyl-1,5-benzodiazepin-3-yl]-3-phenylurea
Molecular weight470.573
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP5.1
Synonyms1-(1,3-Dimethylbutyl)-3-(3-phenylureido)-5-phenyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione
SCHEMBL8638271
Inchi KeyAVGAGBPBTDARPF-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H30N4O3/c1-19(2)18-20(3)31-23-16-10-11-17-24(23)32(22-14-8-5-9-15-22)27(34)25(26(31)33)30-28(35)29-21-12-6-4-7-13-21/h4-17,19-20,25H,18H2,1-3H3,(H2,29,30,35)
PubChem CID10576324
ChEMBLCHEMBL332595
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
Ki2.089 nMPMID11020274ChEMBL

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