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GPCR

NameD(2) dopamine receptor
SpeciesHomo sapiens (Human)
GeneDRD2
Synonymdopamine receptor 2
Dopamine D2 receptor
D2R
D2A and D2B
D2(415) and D2(444)
[ Show all ]
DiseaseSubstance dependence
Major depressive disorder
Maintain blood pressure in hypotensive states
Insomnia
Inflammatory disease
[ Show all ]
Length443
Amino acid sequenceMDPLNLSWYDDDLERQNWSRPFNGSDGKADRPHYNYYATLLTLLIAVIVFGNVLVCMAVSREKALQTTTNYLIVSLAVADLLVATLVMPWVVYLEVVGEWKFSRIHCDIFVTLDVMMCTASILNLCAISIDRYTAVAMPMLYNTRYSSKRRVTVMISIVWVLSFTISCPLLFGLNNADQNECIIANPAFVVYSSIVSFYVPFIVTLLVYIKIYIVLRRRRKRVNTKRSSRAFRAHLRAPLKGNCTHPEDMKLCTVIMKSNGSFPVNRRRVEAARRAQELEMEMLSSTSPPERTRYSPIPPSHHQLTLPDPSHHGLHSTPDSPAKPEKNGHAKDHPKIAKIFEIQTMPNGKTRTSLKTMSRRKLSQQKEKKATQMLAIVLGVFIICWLPFFITHILNIHCDCNIPPVLYSAFTWLGYVNSAVNPIIYTTFNIEFRKAFLKILHC
UniProtP14416
Protein Data Bank6cm4, 6c38
GPCR-HGmod modelP14416
3D structure modelThis structure is from PDB ID 6cm4.
BioLiPBL0408379, BL0403379
Therapeutic Target DatabaseT67162
ChEMBLCHEMBL217
IUPHAR215
DrugBankBE0000756

Ligand

NameCHEMBL3924565
Molecular formulaC20H23Cl2NO
IUPAC name1-(4-chlorophenyl)-4-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)butan-1-one;hydrochloride
Molecular weight364.31
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogPNone
SynonymsBDBM50199128
SCHEMBL20359518
Inchi KeyFPDLYMXLPOEFDP-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H22ClNO.ClH/c21-19-11-9-17(10-12-19)20(23)8-4-14-22-13-3-7-16-5-1-2-6-18(16)15-22;/h1-2,5-6,9-12H,3-4,7-8,13-15H2;1H
PubChem CID134141354
ChEMBLCHEMBL3924565
IUPHARN/A
BindingDB50199128
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Experimental Data

ParameterValueReferenceDatabase source
Ki3548.0 nMPMID27717652BindingDB
Ki3548.13 nMPMID27717652ChEMBL
Ki3578.0 nMPMID27717652BindingDB,ChEMBL

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