BDBM50073996 (S)-2-{(S)-2-[(S)-2-[(S)-2-[3-(4-Benzoyl-phenyl)-propionylamino]-3-(4-fluoro-phenyl)-propionylamino]-3-(4-guanidino-phenyl)-propionylamino]-4-methyl-pentanoylamino}-5-guanidino-pentanoic acid::CHEMBL97498

SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(cc1)\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(F)cc1)-[#7]-[#6](=O)-[#6]-[#6]-c1ccc(cc1)-[#6](=O)-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=[#7])-[#6](-[#8])=O

InChI Key InChIKey=IBATXSJSWVTKMC-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50073996   

TargetProteinase-activated receptor 1(Human)
University At Stony Brook

Curated by ChEMBL
LigandPNGBDBM50073996((S)-2-{(S)-2-[(S)-2-[(S)-2-[3-(4-Benzoyl-phenyl)-p...)
Affinity DataIC50: 3.10E+3nMAssay Description:Human Thrombin receptor 1 (PAR-1) antagonistic ability to inhibit SFLLRN-NH2 (2.7 uM)-induced platelet aggregationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed