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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

NameCHEMBL165022
Molecular formulaC17H25N
IUPAC name4-penta-1,4-diyn-3-ylidene-N,N-dipropylcyclohexan-1-amine
Molecular weight243.394
Hydrogen bond acceptor1
Hydrogen bond donor0
XlogP4.2
Synonyms[4-(1-Ethynyl-prop-2-ynylidene)-cyclohexyl]-dipropyl-amine
BDBM50085336
ZINC13805529
Inchi KeyCFCGTXOJJUJIIE-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H25N/c1-5-13-18(14-6-2)17-11-9-16(10-12-17)15(7-3)8-4/h3-4,17H,5-6,9-14H2,1-2H3
PubChem CID10824155
ChEMBLCHEMBL165022
IUPHARN/A
BindingDB50085336
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki16000.0 nMPMID10691700BindingDB,ChEMBL

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