BDBM32839 MLS000556117::SMR000174869::[(1-methyl-2-oxidanylidene-indol-3-ylidene)amino] benzoate::[(1-methyl-2-oxoindol-3-ylidene)amino] benzoate::benzoic acid [(1-methyl-2-oxo-3-indolylidene)amino] ester::benzoic acid [(2-keto-1-methyl-indolin-3-ylidene)amino] ester::cid_815192

SMILES CN1C(=O)C(=NOC(=O)c2ccccc2)c2ccccc12

InChI Key InChIKey=GBWUJDAJZFVEBT-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 32839   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32839(MLS000556117 | benzoic acid [(1-methyl-2-oxo-3-ind...)
Affinity DataIC50: 4.93E+3nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay
TargetProthrombin(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32839(MLS000556117 | benzoic acid [(1-methyl-2-oxo-3-ind...)
Affinity DataIC50: 5.05E+3nMpH: 7.5 T: 2°CAssay Description:HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2009
Entry Details
PCBioAssay
TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32839(MLS000556117 | benzoic acid [(1-methyl-2-oxo-3-ind...)
Affinity DataIC50: 2.59E+4nMpH: 7.4 T: 2°CAssay Description:Factor XIa (0.23 ug/mL) was incubated with Boc-Glu-Ala-Arg-AMC substrate (15 uM) in 10 uL of assay buffer for 2 hr at room temperature. Read fluoresc...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/26/2009
Entry Details
PCBioAssay