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GPCR

NameNociceptin receptor
SpeciesHomo sapiens (Human)
GeneOPRL1
SynonymMOR-C
KOR-3
NOP receptor
N/OFQ receptor
nociceptin receptor ORL1
[ Show all ]
DiseasePsychiatric disorder
Pain; Stress
Pain
Major depressive disorder
Inflammatory disease
[ Show all ]
Length370
Amino acid sequenceMEPLFPAPFWEVIYGSHLQGNLSLLSPNHSLLPPHLLLNASHGAFLPLGLKVTIVGLYLAVCVGGLLGNCLVMYVILRHTKMKTATNIYIFNLALADTLVLLTLPFQGTDILLGFWPFGNALCKTVIAIDYYNMFTSTFTLTAMSVDRYVAICHPIRALDVRTSSKAQAVNVAIWALASVVGVPVAIMGSAQVEDEEIECLVEIPTPQDYWGPVFAICIFLFSFIVPVLVISVCYSLMIRRLRGVRLLSGSREKDRNLRRITRLVLVVVAVFVGCWTPVQVFVLAQGLGVQPSSETAVAILRFCTALGYVNSCLNPILYAFLDENFKACFRKFCCASALRRDVQVSDRVRSIAKDVALACKTSETVPRPA
UniProtP41146
Protein Data Bank5dhg, 4ea3, 5dhh
GPCR-HGmod modelP41146
3D structure modelThis structure is from PDB ID 5dhg.
BioLiPBL0328039,BL0328040, BL0227293,BL0227294, BL0328041,BL0328042
Therapeutic Target DatabaseT52921
ChEMBLCHEMBL2014
IUPHAR320
DrugBankBE0002378

Ligand

NameCHEMBL95302
Molecular formulaC19H23N5O4
IUPAC name(5S)-2-(hydroxymethyl)-5-[6-(2-propan-2-ylanilino)purin-9-yl]oxolane-3,4-diol
Molecular weight385.424
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP2.3
SynonymsN/A
Inchi KeyAEIAQTQSFDKUPO-SRMCDNDASA-N
Inchi IDInChI=1S/C19H23N5O4/c1-10(2)11-5-3-4-6-12(11)23-17-14-18(21-8-20-17)24(9-22-14)19-16(27)15(26)13(7-25)28-19/h3-6,8-10,13,15-16,19,25-27H,7H2,1-2H3,(H,20,21,23)/t13?,15?,16?,19-/m0/s1
PubChem CID44328202
ChEMBLCHEMBL95302
IUPHARN/A
BindingDB50090694
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC50416.0 nMPMID25898137BindingDB
Ki97.0 nM, PMID25898137, NoneBindingDB,ChEMBL

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