BDBM12815 2,2,2-trifluoroacetic acid; 2-(5-carbamimidoyl-1-benzothiophen-3-yl)-3-phenyl-N-{4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}propanamide::5-Amidinobenzo[b]thiophene 33

SMILES NC(=N)c1ccc2scc(C(Cc3ccccc3)C(=O)Nc3ccc(cc3)-n3ccc(n3)C(F)(F)F)c2c1

InChI Key InChIKey=XMUNTFWDTAXUMK-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 = 12815   

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

LigandPNGBDBM12815(2,2,2-trifluoroacetic acid; 2-(5-carbamimidoyl-1-b...)
Affinity DataKi:  130nMAssay 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

LigandPNGBDBM12815(2,2,2-trifluoroacetic acid; 2-(5-carbamimidoyl-1-b...)
Affinity DataKi:  410nM ΔG°:  -8.62kcal/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