BDBM50074000 (S)-2-{(S)-3-(4-Benzoyl-phenyl)-2-[(S)-2-{(S)-3-(4-fluoro-phenyl)-2-[(E)-(3-phenyl-acryloyl)amino]-propionylamino}-3-(4-guanidino-phenyl)-propionylamino]-propionylamino}-5-guanidino-pentanoic acid::CHEMBL432578

SMILES [#7]\[#6](-[#7])=[#7]/c1ccc(-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(F)cc2)-[#7]-[#6](=O)-[#6]=[#6]-c2ccccc2)-[#6](=O)-[#7]-[#6@@H](-[#6]-c2ccc(cc2)-[#6](=O)-c2ccccc2)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=[#7])-[#6](-[#8])=O)cc1

InChI Key InChIKey=YHYSHKTUTZTIFI-UHFFFAOYSA-N

Data  1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50074000   

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

Curated by ChEMBL
LigandPNGBDBM50074000((S)-2-{(S)-3-(4-Benzoyl-phenyl)-2-[(S)-2-{(S)-3-(4...)
Affinity DataIC50: 6.00E+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