Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only
Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

You can:

GPCR

NameNociceptin receptor
SpeciesRattus norvegicus (Rat)
GeneOprl1
SynonymNOP receptor
NOP-r
NOPr
OP4
Orphanin FQ receptor
[ Show all ]
DiseaseN/A for non-human GPCRs
Length367
Amino acid sequenceMESLFPAPYWEVLYGSHFQGNLSLLNETVPHHLLLNASHSAFLPLGLKVTIVGLYLAVCIGGLLGNCLVMYVILRHTKMKTATNIYIFNLALADTLVLLTLPFQGTDILLGFWPFGNALCKTVIAIDYYNMFTSTFTLTAMSVDRYVAICHPIRALDVRTSSKAQAVNVAIWALASVVGVPVAIMGSAQVEDEEIECLVEIPAPQDYWGPVFAICIFLFSFIIPVLIISVCYSLMIRRLRGVRLLSGSREKDRNLRRITRLVLVVVAVFVGCWTPVQVFVLVQGLGVQPGSETAVAILRFCTALGYVNSCLNPILYAFLDENFKACFRKFCCASSLHREMQVSDRVRSIAKDVGLGCKTSETVPRPA
UniProtP35370
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4503
IUPHAR320
DrugBankN/A

Ligand

NameCHEMBL442305
Molecular formulaC60H98N22O15
IUPAC name(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S,3R)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-N-[(2S)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-1,5-diamino-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]hexanamide
Molecular weight1367.58
Hydrogen bond acceptor20
Hydrogen bond donor22
XlogP-7.3
SynonymsN/A
Inchi KeyPZFQGJHKEDEFIP-RWDFPFHBSA-N
Inchi IDInChI=1S/C60H98N22O15/c1-33(74-46(86)31-73-58(97)48(35(3)84)82-56(95)43(28-37-17-8-5-9-18-37)76-47(87)30-71-45(85)29-72-52(91)38(63)27-36-15-6-4-7-16-36)50(89)78-42(22-14-26-70-60(67)68)54(93)80-40(19-10-11-23-61)55(94)81-44(32-83)57(96)75-34(2)51(90)79-41(21-13-25-69-59(65)66)53(92)77-39(49(64)88)20-12-24-62/h4-9,15-18,33-35,38-44,48,83-84H,10-14,19-32,61-63H2,1-3H3,(H2,64,88)(H,71,85)(H,72,91)(H,73,97)(H,74,86)(H,75,96)(H,76,87)(H,77,92)(H,78,89)(H,79,90)(H,80,93)(H,81,94)(H,82,95)(H4,65,66,69)(H4,67,68,70)/t33-,34-,35+,38-,39-,40-,41-,42-,43-,44-,48-/m0/s1
PubChem CID44414339
ChEMBLCHEMBL442305
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
Activity0.04 -PMID16714110ChEMBL
Activity0.05 -PMID16714110ChEMBL
Activity0.09 -PMID16714110ChEMBL
EC506165.95 nMPMID16714110ChEMBL
EC509332.54 nMPMID16714110ChEMBL
EC5010964.8 nMPMID16714110ChEMBL
EC5011220.2 nMPMID16714110ChEMBL
Emax-60.0 %PMID16714110ChEMBL
Emax-57.0 %PMID16714110ChEMBL
Emax-49.0 %PMID16714110ChEMBL
Emax-33.0 %PMID16714110ChEMBL

zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417