BDBM12814 2,2,2-trifluoroacetic acid; 2-(5-carbamimidoyl-1-benzothiophen-3-yl)-N-(4-methylcyclohexyl)-3-phenylpropanamide::5-Amidinobenzo[b]thiophene 32

SMILES CC1CCC(CC1)NC(=O)C(Cc1ccccc1)c1csc2ccc(cc12)C(N)=N

InChI Key InChIKey=GRRWSGURXRCOGN-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 12814   

TargetCoagulation factor IX(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

LigandPNGBDBM12814(2,2,2-trifluoroacetic acid; 2-(5-carbamimidoyl-1-b...)
Affinity DataKi:  580nMAssay Description:Ki values were obtained from human purified enzyme. All assays were run in microtiter plates. Plates were read for 30 min at 405 nm. Rates were deter...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/1/2007
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

LigandPNGBDBM12814(2,2,2-trifluoroacetic acid; 2-(5-carbamimidoyl-1-b...)
Affinity DataKi:  3.24E+3nM ΔG°:  -7.41kcal/molepH: 7.0 T: 2°CAssay Description:Ki values were obtained from human purified enzyme. All assays were run in microtiter plates. Plates were read for 30 min at 405 nm. Rates were deter...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/1/2007
Entry Details Article
PubMed