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GPCR

NameD(1) dopamine receptor
SpeciesCarassius auratus (Goldfish)
Gene
SynonymDopamine D1 receptor
DiseaseN/A for non-human GPCRs
Length363
Amino acid sequenceMAVLDLNLTTVIDSGFMESDRSVRVLTGCFLSVLILSTLLGNTLVCAAVTKFRHLRSKVTNFFVISLAVSDLLVAVLVMPWKAVTEVAGFWPFGAFCDIWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTPRVAFVMISGAWTLSVLISFIPVQLKWHKAQPIGFLEVNASRRDLPTDNCDSSLNRTYAISSSLISFYIPVAIMIVTYTQIYRIAQKQIRRISALERAAESAQIRHDSMGSGSNMDLESSFKLSFKRETKVLKTLSVIMGVFVCCWLPFFILNCMVPFCKRTSNGLPCISPTTFDVFVWFGWANSSLNPIIYAFNADFRRAFAILLGCQRLCPGSISMETPSLNKN
UniProtP35406
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2368
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL416435
Molecular formulaC22H21NO2S
IUPAC name(1R,10S)-15-(3-methylphenyl)-14-thia-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6,13(17),15-pentaene-4,5-diol
Molecular weight363.475
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP4.3
Synonyms(5aS,11bR)-2-m-Tolyl-4,5,5a,6,7,11b-hexahydro-3-thia-5-aza-cyclopenta[c]phenanthrene-9,10-diol
BDBM50057847
2-(3-Methylphenyl)-4,5,5aalpha,6,7,11bbeta-hexahydro-3-thia-5-aza-3H-cyclopenta[c]phenanthrene-9,10-diol
Inchi KeyGKLDXZHGPYSMOV-HTAPYJJXSA-N
Inchi IDInChI=1S/C22H21NO2S/c1-12-3-2-4-14(7-12)20-10-16-21(26-20)11-23-17-6-5-13-8-18(24)19(25)9-15(13)22(16)17/h2-4,7-10,17,22-25H,5-6,11H2,1H3/t17-,22+/m0/s1
PubChem CID10666423
ChEMBLCHEMBL416435
IUPHARN/A
BindingDB50057847
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC50640.0 nMPMID9171869BindingDB,ChEMBL
IA70.0 %PMID9171869ChEMBL

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