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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

NameCHEMBL1271236
Molecular formulaC20H32N4O4
IUPAC nameN-[(2S)-1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-2-methyl-1,3-oxazole-4-carboxamide
Molecular weight392.5
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP3.5
SynonymsBDBM50329486
4-(2-Methyloxazoyl)-Cha-Ile-NH2
Inchi KeyCVJTZEAKXFGAEL-NUTKFTJISA-N
Inchi IDInChI=1S/C20H32N4O4/c1-4-12(2)17(18(21)25)24-19(26)15(10-14-8-6-5-7-9-14)23-20(27)16-11-28-13(3)22-16/h11-12,14-15,17H,4-10H2,1-3H3,(H2,21,25)(H,23,27)(H,24,26)/t12-,15-,17-/m0/s1
PubChem CID49788155
ChEMBLCHEMBL1271236
IUPHARN/A
BindingDB50329486
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC50<100000.0 nMPMID20873792BindingDB,ChEMBL

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