BDBM50506477 CHEMBL4456162::US11311527, Cpd ID I-5::US11376246, Cpd ID I-5::US11576906, Compound I-5

SMILES Clc1ccc2[nH]c(=O)c(CNc3cccn(C4CC4)c3=O)cc2c1

InChI Key InChIKey=DHDHUTUALAFFMG-UHFFFAOYSA-N

Data  7 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50506477   

TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132H](Human)
Forma Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 50506477BDBM50506477(CHEMBL4456162 | US11376246, Cpd ID I-5 | US1157690...)
Affinity DataIC50: 550nMAssay Description:Compound 1 was not initially reported as having the greatest biochemical potency compared to reports for certain other small molecule inhibitors of m...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/31/2023
Entry Details
US Patent

TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132H](Human)
Forma Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 50506477BDBM50506477(CHEMBL4456162 | US11376246, Cpd ID I-5 | US1157690...)
Affinity DataIC50: 550nMAssay Description:Please see paper.More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/5/2022
Entry Details
US Patent

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Forma Therapeutics

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50506477BDBM50506477(CHEMBL4456162 | US11376246, Cpd ID I-5 | US1157690...)
Affinity DataIC50: 694nMAssay Description:Inhibition of recombinant human Myc-DDK-tagged IDH1 R132H mutant using alpha-ketoglutarate as substrate preincubated for 15 mins followed by substrat...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2021
Entry Details Article
PubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132C](Human)
Forma Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 50506477BDBM50506477(CHEMBL4456162 | US11376246, Cpd ID I-5 | US1157690...)
Affinity DataIC50: 1.00E+4nMAssay Description:Compound 1 was not initially reported as having the greatest biochemical potency compared to reports for certain other small molecule inhibitors of m...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/31/2023
Entry Details
US Patent

TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132C](Human)
Forma Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 50506477BDBM50506477(CHEMBL4456162 | US11376246, Cpd ID I-5 | US1157690...)
Affinity DataIC50: 1.00E+4nMAssay Description:Please see paper.More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/5/2022
Entry Details
US Patent