BDBM14133 (2S)-N-[(1R)-1-(4-aminocyclohexyl)-3-(1,3-benzothiazol-2-yl)-3-oxopropyl]-1-[(2R)-2-(methylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxamide::2-ketobenzothiazole 71::The absolute stereochemistry of the carbon thatbears the cyclohexyl ring is unknown::The relative stereochemistry of the cyclohexyl ring is trans

SMILES CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC(=O)c1nc2ccccc2s1)C1CC[C@H](N)CC1

InChI Key InChIKey=ZDJAWPTWLQRSCD-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 14133   

TargetProthrombin(Human)
Johnson & Johnson Pharmaceutical

LigandPNGBDBM14133((2S)-N-[(1R)-1-(4-aminocyclohexyl)-3-(1,3-benzothi...)
Affinity DataIC50: 1.00E+5nMAssay Description:Thrombin-catalyzed hydrolysis rates were measured spectrophotometrically using human alpha-thrombin, a chromogenic substrate in aqueous buffer, and a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/5/2007
Entry Details Article
PubMed
TargetSerine protease 1(Bovine)
Johnson & Johnson Pharmaceutical

LigandPNGBDBM14133((2S)-N-[(1R)-1-(4-aminocyclohexyl)-3-(1,3-benzothi...)
Affinity DataIC50: 5.80E+4nMAssay Description:Thrombin-catalyzed hydrolysis rates were measured spectrophotometrically using human alpha-thrombin, a chromogenic substrate in aqueous buffer, and a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/5/2007
Entry Details Article
PubMed