BDBM50289562 CHEMBL3216390::CHEMBL543774::{(R)-1-Cyclohexylmethyl-2-[(S)-2-(3-guanidino-propylcarbamoyl)-piperidin-1-yl]-2-oxo-ethylamino}-acetic acid; dihydrochloride

SMILES NC(=N)NCCCNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CC1CCCCC1)NCC(O)=O

InChI Key InChIKey=CDPROXZBMHOBTQ-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 50289562   

TargetProthrombin(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50289562({(R)-1-Cyclohexylmethyl-2-[(S)-2-(3-guanidino-prop...)
Affinity DataKi:  3nMAssay Description:Selective inhibition of thrombin in several in vitro and in vivo models of thrombosisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2010
Entry Details Article

TargetProthrombin(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50289562({(R)-1-Cyclohexylmethyl-2-[(S)-2-(3-guanidino-prop...)
Affinity DataKi:  15nMAssay Description:Selective inhibition of thrombin in several in vitro and in vivo models of thrombosisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2010
Entry Details Article

TargetSerine protease 1(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50289562({(R)-1-Cyclohexylmethyl-2-[(S)-2-(3-guanidino-prop...)
Affinity DataKi:  45nMAssay Description:Selective inhibition of thrombin in several in vitro and in vivo models of thrombosisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2010
Entry Details Article