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GPCR

NameDelta-type opioid receptor
SpeciesHomo sapiens (Human)
GeneOPRD1
SynonymDOP
OP1
DOR-1
DOR
D-OR-1
[ Show all ]
DiseaseUrinary incontinence
Rheumatoid arthritis
Premature ejaculation
Pain
Overactive bladder disorder
[ Show all ]
Length372
Amino acid sequenceMEPAPSAGAELQPPLFANASDAYPSACPSAGANASGPPGARSASSLALAIAITALYSAVCAVGLLGNVLVMFGIVRYTKMKTATNIYIFNLALADALATSTLPFQSAKYLMETWPFGELLCKAVLSIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPAKAKLINICIWVLASGVGVPIMVMAVTRPRDGAVVCMLQFPSPSWYWDTVTKICVFLFAFVVPILIITVCYGLMLLRLRSVRLLSGSKEKDRSLRRITRMVLVVVGAFVVCWAPIHIFVIVWTLVDIDRRDPLVVAALHLCIALGYANSSLNPVLYAFLDENFKRCFRQLCRKPCGRPDPSSFSRAREATARERVTACTPSDGPGGGAAA
UniProtP41143
Protein Data Bank4n6h, 4rwd, 4rwa
GPCR-HGmod modelP41143
3D structure modelThis structure is from PDB ID 4n6h.
BioLiPBL0265712, BL0265705,BL0265706,BL0265707,, BL0303699,BL0303701, BL0303698,BL0303700, BL0303696,BL0303697
Therapeutic Target DatabaseT58992
ChEMBLCHEMBL236
IUPHAR317
DrugBankBE0000420

Ligand

NameCHEMBL230943
Molecular formulaC27H31N3O2
IUPAC nameN-[1-[(2S)-2-amino-3-naphthalen-2-ylpropanoyl]piperidin-4-yl]-N-phenylpropanamide
Molecular weight429.564
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.1
Synonyms(S)-N-(1-(2-amino-3-(naphthalen-2-yl)propanoyl)piperidin-4-yl)-N-phenylpropionamide
BDBM50206651
Inchi KeyAFTDOBSJNHHDAP-VWLOTQADSA-N
Inchi IDInChI=1S/C27H31N3O2/c1-2-26(31)30(23-10-4-3-5-11-23)24-14-16-29(17-15-24)27(32)25(28)19-20-12-13-21-8-6-7-9-22(21)18-20/h3-13,18,24-25H,2,14-17,19,28H2,1H3/t25-/m0/s1
PubChem CID44425373
ChEMBLCHEMBL230943
IUPHARN/A
BindingDB50206651
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki3300.0 nMPMID17329100BindingDB,ChEMBL

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