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GPCR

NameD(1A) dopamine receptor
SpeciesBos taurus (Bovine)
GeneDRD1
SynonymDopamine D1 receptor
DiseaseN/A for non-human GPCRs
Length446
Amino acid sequenceMRTLNTSTMEGTGLVAERDFSFRILTACFLSLLILSTLLGNTLVCAAVIRFRHLRSKVTNFFVISLAVSDLLVAVLVMPWKAVAEIAGFWPFGSFCNIWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTPKAAFILISVAWTLSVLISFIPVQLSWHKAKPTGPSEGNATSLGKTINNCDSSLSRTYAISSSLISFYIPVAIMIVTYTRIYRIAQKQIRRISALERAAVHAKNCQTTTGNGNPMECSQPESSFKMSFKRETKVLKTLSVIMGVFVCCWLPFFILNCMVPFCGSGETKPFCIDSITFDVFVWFGWANSSLNPIIYAFNADFRKAFSTLLGCYRLCPTTNNAIETVSINNNGAVVFSSHHEPRGSISKDCNVVYLIPHAVGSSEGLKKEEAVGIAKPLEKLSPALSVILDYDTDVSLEKIQPITQNGQHPT
UniProtQ95136
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2967
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL561123
Molecular formulaC22H28N6O2
IUPAC name3-methyl-2-morpholin-4-yl-7-[(4-phenylpiperazin-1-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidin-4-one
Molecular weight408.506
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP1.1
SynonymsBDBM50295929
3-Methyl-2-morpholin-4-yl-7-[(4-phenylpiperazin-1-yl)methyl]-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Inchi KeyBPXOVNRRDFBZBM-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H28N6O2/c1-25-21(29)20-19(24-22(25)28-11-13-30-14-12-28)17(15-23-20)16-26-7-9-27(10-8-26)18-5-3-2-4-6-18/h2-6,15,23H,7-14,16H2,1H3
PubChem CID45268293
ChEMBLCHEMBL561123
IUPHARN/A
BindingDB50295929
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki520.0 nMPMID19481941BindingDB,ChEMBL

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