BDBM22807 2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(3-methylphenyl)acetamide::Isatin-based compound, 27::LOR-NOR-30067bb9-8

SMILES Cc1cccc(NC(=O)CN2C(=O)C(=O)c3ccccc23)c1

InChI Key InChIKey=UTYQTGGBFCQOTL-UHFFFAOYSA-N

Data  5 KI  1 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 6 hits for monomerid = 22807   

TargetLiver carboxylesterase 1(Homo sapiens (Human))
St. Jude Research Hospital

LigandPNGBDBM22807(2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(3-methy...)
Affinity DataKi:  4.35E+3nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLiver carboxylesterase 1(Oryctolagus cuniculus (rabbit))
St. Jude Research Hospital

LigandPNGBDBM22807(2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(3-methy...)
Affinity DataKi:  4.90E+3nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCoagulation factor XII(Homo sapiens (Human))
St. Jude Research Hospital

LigandPNGBDBM22807(2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(3-methy...)
Affinity DataKi:  5.51E+3nM ΔG°:  -7.17kcal/molepH: 7.4 T: 2°CAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCholinesterase(Homo sapiens (Human))
St. Jude Research Hospital

LigandPNGBDBM22807(2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(3-methy...)
Affinity DataKi:  2.10E+4nMAssay Description:The cholinesterase assays were performed using colorimetric method reported by Ellman. Estimates of the competitive inhibition constants (Ki) were ob...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
St. Jude Research Hospital

LigandPNGBDBM22807(2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(3-methy...)
Affinity DataKi: >1.00E+5nMAssay Description:The cholinesterase assays were performed using colorimetric method reported by Ellman. Estimates of the competitive inhibition constants (Ki) were ob...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution of Biological Research

LigandPNGBDBM22807(2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)-N-(3-methy...)
Affinity DataIC50:  4.24E+4nMAssay Description:The assay was performed according to the published procedure. Briefly, compounds were seeded into assay-ready plates (Greiner 384PP, cat# 781280) usi...More data for this Ligand-Target Pair
In DepthDetails