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GPCR

NameD(2) dopamine receptor
SpeciesRattus norvegicus (Rat)
GeneDrd2
SynonymD2 receptor
D2(415) and D2(444)
D2A and D2B
D2R
Dopamine D2 receptor
[ Show all ]
DiseaseN/A for non-human GPCRs
Length444
Amino acid sequenceMDPLNLSWYDDDLERQNWSRPFNGSEGKADRPHYNYYAMLLTLLIFIIVFGNVLVCMAVSREKALQTTTNYLIVSLAVADLLVATLVMPWVVYLEVVGEWKFSRIHCDIFVTLDVMMCTASILNLCAISIDRYTAVAMPMLYNTRYSSKRRVTVMIAIVWVLSFTISCPLLFGLNNTDQNECIIANPAFVVYSSIVSFYVPFIVTLLVYIKIYIVLRKRRKRVNTKRSSRAFRANLKTPLKGNCTHPEDMKLCTVIMKSNGSFPVNRRRMDAARRAQELEMEMLSSTSPPERTRYSPIPPSHHQLTLPDPSHHGLHSNPDSPAKPEKNGHAKIVNPRIAKFFEIQTMPNGKTRTSLKTMSRRKLSQQKEKKATQMLAIVLGVFIICWLPFFITHILNIHCDCNIPPVLYSAFTWLGYVNSAVNPIIYTTFNIEFRKAFMKILHC
UniProtP61169
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL339
IUPHAR215
DrugBankN/A

Ligand

Namedomperidone
Molecular formulaC22H24ClN5O2
IUPAC name6-chloro-3-[1-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-2-one
Molecular weight425.917
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP3.9
SynonymsNCGC00014670-04
NCGC00014670-12
NCGC00021472-04
NCI60_002512
Pharmakon1600-02300212
[ Show all ]
Inchi KeyFGXWKSZFVQUSTL-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)
PubChem CID3151
ChEMBLCHEMBL219916
IUPHAR965
BindingDB50241107
DrugBankDB01184

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
ED50<40.0 mg.kg-1PMID3397992ChEMBL
IC502.5 nMPMID9871571BindingDB,ChEMBL
IC502.8 nMPMID7914538BindingDB,ChEMBL
IC505.2 nMPMID3397992BindingDB,ChEMBL
IC5013.6 nMPMID12593651BindingDB,ChEMBL
K0.51.0 nMPMID8568818, PMID7636869ChEMBL
Ki0.2 nMPMID11044891BindingDB
Ki0.28 nMPMID8278895BindingDB
Ki0.3 nMPMID1975644, PMID2958621BindingDB
Ki0.34 nMPMID8278895BindingDB
Ki0.52 nMMed Chem Res, (2004) 13:1:25ChEMBL
Ki0.53 nMPMID8278895BindingDB
Ki0.57 nMMed Chem Res, (2004) 13:1:25ChEMBL
Ki0.61 nMPMID6655559BindingDB
Ki0.7 nMPMID3828800BindingDB
Ki0.72 nMPMID2415793, PMID6655559BindingDB
Ki1.2 nMPMID2958621BindingDB
Ki3.16228 nMPMID1975644IUPHAR

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