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GPCR

NameD(4) dopamine receptor
SpeciesHomo sapiens (Human)
GeneDRD4
SynonymD4 receptor
D4R
Dopamine D4 receptor
dopamine receptor 4
d(2C) dopamine receptor
DiseaseErectile dysfunction
Psychotic disorders
Schizophrenia
Length467
Amino acid sequenceMGNRSTADADGLLAGRGPAAGASAGASAGLAGQGAAALVGGVLLIGAVLAGNSLVCVSVATERALQTPTNSFIVSLAAADLLLALLVLPLFVYSEVQGGAWLLSPRLCDALMAMDVMLCTASIFNLCAISVDRFVAVAVPLRYNRQGGSRRQLLLIGATWLLSAAVAAPVLCGLNDVRGRDPAVCRLEDRDYVVYSSVCSFFLPCPLMLLLYWATFRGLQRWEVARRAKLHGRAPRRPSGPGPPSPTPPAPRLPQDPCGPDCAPPAPGLPRGPCGPDCAPAAPGLPPDPCGPDCAPPAPGLPQDPCGPDCAPPAPGLPRGPCGPDCAPPAPGLPQDPCGPDCAPPAPGLPPDPCGSNCAPPDAVRAAALPPQTPPQTRRRRRAKITGRERKAMRVLPVVVGAFLLCWTPFFVVHITQALCPACSVPPRLVSAVTWLGYVNSALNPVIYTVFNAEFRNVFRKALRACC
UniProtP21917
Protein Data Bank5wiv, 5wiu
GPCR-HGmod modelP21917
3D structure modelThis structure is from PDB ID 5wiv.
BioLiPBL0394824, BL0394826, BL0394825
Therapeutic Target DatabaseT24983
ChEMBLCHEMBL219
IUPHAR217
DrugBankBE0009376, BE0000389

Ligand

NameCHEMBL397770
Molecular formulaC20H20Cl2N2O
IUPAC name4-(2,3-dichlorophenyl)-1-(1H-indol-3-ylmethyl)piperidin-4-ol
Molecular weight375.293
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP4.3
Synonyms4-Piperidinol, 4-(2,3-dichlorophenyl)-1-(1H-indol-3-ylmethyl)-
DTXSID80659090
AKOS030550425
1-((1H-indol-3-yl)methyl)-4-(2,3-dichlorophenyl)piperidin-4-ol
BDBM50198272
[ Show all ]
Inchi KeyASKCQUQTSBOXCM-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H20Cl2N2O/c21-17-6-3-5-16(19(17)22)20(25)8-10-24(11-9-20)13-14-12-23-18-7-2-1-4-15(14)18/h1-7,12,23,25H,8-11,13H2
PubChem CID44438197
ChEMBLCHEMBL397770
IUPHARN/A
BindingDB50198272
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki1550.0 nMPMID17095222BindingDB,ChEMBL

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