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GPCR

NameDelta-type opioid receptor
SpeciesHomo sapiens (Human)
GeneOPRD1
SynonymD-OR-1
DOR
opioid receptor
OP1
DOP
[ Show all ]
DiseaseCough
Overactive bladder disorder
Bladder disease
Moderate-to-severe pain
Diarrhea-predominant IBS
[ Show all ]
Length372
Amino acid sequenceMEPAPSAGAELQPPLFANASDAYPSACPSAGANASGPPGARSASSLALAIAITALYSAVCAVGLLGNVLVMFGIVRYTKMKTATNIYIFNLALADALATSTLPFQSAKYLMETWPFGELLCKAVLSIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPAKAKLINICIWVLASGVGVPIMVMAVTRPRDGAVVCMLQFPSPSWYWDTVTKICVFLFAFVVPILIITVCYGLMLLRLRSVRLLSGSKEKDRSLRRITRMVLVVVGAFVVCWAPIHIFVIVWTLVDIDRRDPLVVAALHLCIALGYANSSLNPVLYAFLDENFKRCFRQLCRKPCGRPDPSSFSRAREATARERVTACTPSDGPGGGAAA
UniProtP41143
Protein Data Bank4rwd, 4rwa, 4n6h
GPCR-HGmod modelP41143
3D structure modelThis structure is from PDB ID 4rwd.
BioLiPBL0303696,BL0303697, BL0265712, BL0265705,BL0265706,BL0265707,, BL0303699,BL0303701, BL0303698,BL0303700
Therapeutic Target DatabaseT58992
ChEMBLCHEMBL236
IUPHAR317
DrugBankBE0000420

Ligand

NameCHEMBL188841
Molecular formulaC14H21NO
IUPAC name7-(dimethylamino)-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-ol
Molecular weight219.328
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP3.2
SynonymsAKOS022653453
BDBM50154203
SCHEMBL7440326
7-(dimethylamino)-8,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol
Inchi KeyADDSXGPNDGSYDB-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H21NO/c1-14(2)12-9-11(16)7-5-10(12)6-8-13(14)15(3)4/h5,7,9,13,16H,6,8H2,1-4H3
PubChem CID11264459
ChEMBLCHEMBL188841
IUPHARN/A
BindingDB50154203
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki4010.0 nMPMID15456250BindingDB,ChEMBL

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