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GPCR

NameCholecystokinin receptor type A
SpeciesHomo sapiens (Human)
GeneCCKAR
Synonymcholecystokinin-1 receptor
CCK1-R
CCK1 receptor
CCK-AR
CCK-A receptor
[ Show all ]
DiseasePancreatic cancer; Obesity
Eating disorder
Pancreatic disease
Gallstone prophylaxis; Obesity
Gastrointestinal disease
[ Show all ]
Length428
Amino acid sequenceMDVVDSLLVNGSNITPPCELGLENETLFCLDQPRPSKEWQPAVQILLYSLIFLLSVLGNTLVITVLIRNKRMRTVTNIFLLSLAVSDLMLCLFCMPFNLIPNLLKDFIFGSAVCKTTTYFMGTSVSVSTFNLVAISLERYGAICKPLQSRVWQTKSHALKVIAATWCLSFTIMTPYPIYSNLVPFTKNNNQTANMCRFLLPNDVMQQSWHTFLLLILFLIPGIVMMVAYGLISLELYQGIKFEASQKKSAKERKPSTTSSGKYEDSDGCYLQKTRPPRKLELRQLSTGSSSRANRIRSNSSAANLMAKKRVIRMLIVIVVLFFLCWMPIFSANAWRAYDTASAERRLSGTPISFILLLSYTSSCVNPIIYCFMNKRFRLGFMATFPCCPNPGPPGARGEVGEEEEGGTTGASLSRFSYSHMSASVPPQ
UniProtP32238
Protein Data Bank1d6g
GPCR-HGmod modelP32238
3D structure modelThis structure is from PDB ID 1d6g.
BioLiPBL0007611
Therapeutic Target DatabaseT28330
ChEMBLCHEMBL1901
IUPHAR76
DrugBankBE0000402

Ligand

NameCHEMBL478397
Molecular formulaC34H34N4O2
IUPAC name[2-(4-methylphenyl)-1-(3-propan-2-yloxyphenyl)imidazol-4-yl]-(4-naphthalen-2-ylpiperazin-1-yl)methanone
Molecular weight530.672
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP7.1
SynonymsBDBM50262970
SCHEMBL3135157
(1-(3-isopropoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl)(4-(naphthalen-2-yl)piperazin-1-yl)methanone
Inchi KeyBXYVSADCGZSZPK-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H34N4O2/c1-24(2)40-31-10-6-9-30(22-31)38-23-32(35-33(38)27-13-11-25(3)12-14-27)34(39)37-19-17-36(18-20-37)29-16-15-26-7-4-5-8-28(26)21-29/h4-16,21-24H,17-20H2,1-3H3
PubChem CID24785430
ChEMBLCHEMBL478397
IUPHARN/A
BindingDB50262970
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
Activity94.0 %PMID18614364ChEMBL
EC5053.0 nMPMID18614364BindingDB,ChEMBL
IC5030.0 nMPMID18614364BindingDB,ChEMBL

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