BDBM287791 6-(5,11-dihydro-6H- pyrido[2,3-b] [1,5]benzodiazepin-6- ylcarbonyl)spiro[3.3]heptane- 2-carboxylic acid::US10086000, Example 9::US10508108, Example 9

SMILES OC(=O)C1CC2(C1)CC(C2)C(=O)N1Cc2cccnc2Nc2ccccc12

InChI Key InChIKey=DQEKQIMBUUOBKX-UHFFFAOYSA-N

Data  2 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 = 287791   

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Nanjing University of Chinese Medicine

Curated by ChEMBL
LigandPNGBDBM287791(US10086000, Example 9 | 6-(5,11-dihydro-6H- pyrido...)
Affinity DataIC50: 30nMAssay Description:Inhibition of C-terminal His8-tagged human recombinant IDH1 R132H mutant expressed as Escherichia coli BL21 (DE3) cells using alpha KG as substrate p...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132H](Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM287791(US10086000, Example 9 | 6-(5,11-dihydro-6H- pyrido...)
Affinity DataIC50: 3.94E+4nMpH: 7.0 T: 2°CAssay Description:Each test compound (10 mM stock in DMSO) is diluted in DMSO to make a 10-point, 3-fold dilution series. 125 nL of each dilution or DMSO alone is disp...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/17/2019
Entry Details
US Patent

TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132H](Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM287791(US10086000, Example 9 | 6-(5,11-dihydro-6H- pyrido...)
Affinity DataIC50: 3.94E+4nMAssay Description:Each test compound (10 mM stock in DMSO) is diluted in DMSO to make a 10-point, 3-fold dilution series. 125 nL of each dilution or DMSO alone is disp...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2020
Entry Details
US Patent