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GPCR

NameProteinase-activated receptor 2
SpeciesHomo sapiens (Human)
GeneF2RL1
SynonymProtease-activated receptor-2
PAR2
PAR-2
GPR11
G-protein coupled receptor 11
[ Show all ]
DiseaseN/A
Length397
Amino acid sequenceMRSPSAAWLLGAAILLAASLSCSGTIQGTNRSSKGRSLIGKVDGTSHVTGKGVTVETVFSVDEFSASVLTGKLTTVFLPIVYTIVFVVGLPSNGMALWVFLFRTKKKHPAVIYMANLALADLLSVIWFPLKIAYHIHGNNWIYGEALCNVLIGFFYGNMYCSILFMTCLSVQRYWVIVNPMGHSRKKANIAIGISLAIWLLILLVTIPLYVVKQTIFIPALNITTCHDVLPEQLLVGDMFNYFLSLAIGVFLFPAFLTASAYVLMIRMLRSSAMDENSEKKRKRAIKLIVTVLAMYLICFTPSNLLLVVHYFLIKSQGQSHVYALYIVALCLSTLNSCIDPFVYYFVSHDFRDHAKNALLCRSVRTVKQMQVSLTSKKHSRKSSSYSSSSTTVKTSY
UniProtP55085
Protein Data Bank5ndz, 5ndd
GPCR-HGmod modelP55085
3D structure modelThis structure is from PDB ID 5ndz.
BioLiPBL0377325, BL0377326
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5963
IUPHAR348
DrugBankN/A

Ligand

NameCHEMBL3923129
Molecular formulaC32H46N4O6
IUPAC nameN-[(2S)-3-cyclohexyl-1-[[(2S,3S)-1-[4-(2,5-dimethoxyphenyl)piperidin-1-yl]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
Molecular weight582.742
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP5.9
SynonymsN/A
Inchi KeyHWCSFDYYGSQZCZ-VFXRXZKFSA-N
Inchi IDInChI=1S/C32H46N4O6/c1-5-21(2)29(32(39)36-17-14-23(15-18-36)25-20-24(40-3)11-12-27(25)41-4)35-30(37)26(19-22-9-7-6-8-10-22)34-31(38)28-13-16-33-42-28/h11-13,16,20-23,26,29H,5-10,14-15,17-19H2,1-4H3,(H,34,38)(H,35,37)/t21-,26-,29-/m0/s1
PubChem CID56640178
ChEMBLCHEMBL3923129
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
Inhibition43.0 %PMID27994760ChEMBL

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