BDBM415987 1-(6-{[trans-4-(1- methylethoxy)cyclohexyl]- carbonyl}-6,11- dihydro-5H-pyrido[2,3- b][1,5]benzodiazepin-8- yl)cyclopropanecarbo- nitrile::US10442819, Example 137

SMILES CC(C)O[C@H]1CC[C@H](C(=O)N2Cc3cccnc3Nc3ccc(C4(C#N)CC4)cc32)CC1

InChI Key InChIKey=MYKYWLOGLNIXHI-UHFFFAOYSA-N

Data  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 1 hit for monomerid = 415987   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 415987BDBM415987(US10442819, Example 137 | 1-(6-{[trans-4-(1- methy...)
Affinity DataIC50: 15nMAssay 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:
8/24/2020
Entry Details
US Patent