BDBM50111796 CHEMBL3605384

SMILES O=C1NC(=S)N\C1=C\c1ccc(=O)[nH]c1

InChI Key InChIKey=ZQOHYTLVOUGCOT-CGJGWCQRSA-N

Data  3 KI  3 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50111796   

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50111796(CHEMBL3605384)
Affinity DataKi:  420nMAssay Description:Inhibition of recombinant human IDH1 R132H mutant expressed in Escherichia coli using alpha-KG as substrate preincubated for 5 mins followed by subst...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50111796(CHEMBL3605384)
Affinity DataKi:  2.30E+3nMAssay Description:Inhibition of recombinant human IDH1 R132C mutant expressed in Escherichia coli using alpha-KG as substrate preincubated for 5 mins followed by subst...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50111796(CHEMBL3605384)
Affinity DataKi:  1.03E+4nMAssay Description:Inhibition of recombinant human wild type IDH1 expressed in Escherichia coli using sodium (D)-isocitrate as substrate assessed as production of NADPHMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50111796(CHEMBL3605384)
Affinity DataKd:  8.90E+3nMAssay Description:Binding affinity to recombinant human IDH1 R132H mutant expressed in Escherichia coli by isothermal titration calorimetric analysis in presence of NA...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50111796(CHEMBL3605384)
Affinity DataKd:  4.60E+4nMAssay Description:Binding affinity to recombinant human IDH1 R132H mutant expressed in Escherichia coli by isothermal titration calorimetric analysis in presence of NA...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50111796(CHEMBL3605384)
Affinity DataKd:  5.90E+3nMAssay Description:Binding affinity to recombinant human IDH1 R132H mutant expressed in Escherichia coli by isothermal titration calorimetric analysis in absence of NAD...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed