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GPCR

NameGastrin/cholecystokinin type B receptor
SpeciesMus musculus (Mouse)
GeneCckbr
SynonymCHOLREC
Cholecystokinin-2 receptor
CCK2-R
CCK2 receptor
CCK-BR
[ Show all ]
DiseaseN/A for non-human GPCRs
Length453
Amino acid sequenceMDLLKLNRSLQGPGPGSGSSLCRPGVSLLNSSSAGNLSCETPRIRGTGTRELELTIRITLYAVIFLMSVGGNVLIIVVLGLSRRLRTVTNAFLLSLAVSDLLLAVACMPFTLLPNLMGTFIFGTVICKAVSYLMGVSVSVSTLNLAAIALERYSAICRPLQARVWQTRSHAARVILATWLLSGLLMVPYPVYTVVQPVGPRILQCMHLWPSERVQQMWSVLLLILLFFIPGVVMAVAYGLISRELYLGLRFDGDNDSETQSRVRNQGGLPGGAAAPGPVHQNGGCRHVTSLTGEDSDGCYVQLPRSRLEMTTLTTPTTGPGPGPRPNQAKLLAKKRVVRMLLVIVLLFFVCWLPVYSANTWRAFDGPGARRALAGAPISFIHLLSYTSACANPLVYCFMHRRFRQACLDTCARCCPRPPRARPRPLPDEDPPTPSIASLSRLSYTTISTLGPG
UniProtP56481
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2854
IUPHAR77
DrugBankN/A

Ligand

NameCHEMBL423803
Molecular formulaC24H22N6O6S2
IUPAC name3-[[4-[2-(1H-indol-3-yl)ethylsulfamoyl]-2-nitroanilino]carbamothioylamino]benzoic acid
Molecular weight554.596
Hydrogen bond acceptor9
Hydrogen bond donor6
XlogP4.4
Synonyms3-[2-[2-Nitro-4-[2-(1H-indole-3-yl)ethylsulfamoyl]phenyl]hydrazinocarbonothioylamino]benzoic acid
BDBM50097737
Inchi KeyMPYPGKMTMWSHCR-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22N6O6S2/c31-23(32)15-4-3-5-17(12-15)27-24(37)29-28-21-9-8-18(13-22(21)30(33)34)38(35,36)26-11-10-16-14-25-20-7-2-1-6-19(16)20/h1-9,12-14,25-26,28H,10-11H2,(H,31,32)(H2,27,29,37)
PubChem CID44375212
ChEMBLCHEMBL423803
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
IC5031000.0 nMPMID11266174ChEMBL

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