BDBM287867 6-{[(1S,3aR,4R,6aR)-4- ethoxyoctahydropentalen- 1-yl]carbonyl}-8-[(1S,4S)- 2-oxa-5- azabicyclo[2.2.1]hept-5- yl]-6,11-dihydro-5H- pyrido[2,3-b] [1,5]benzodiazepine::US10086000, Example 84::US10508108, Example 84

SMILES CCO[C@@H]1CC[C@@H]2[C@H]1CC[C@@H]2C(=O)N1Cc2cccnc2Nc2ccc(cc12)N1C[C@@H]2C[C@H]1CO2

InChI Key

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 2 hits for monomerid = 287867   

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

US Patent
LigandPNGBDBM287867(US10086000, Example 84 | 6-{[(1S,3aR,4R,6aR)-4- et...)
Affinity DataIC50: 56nMpH: 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
Go to US Patent

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

US Patent
LigandPNGBDBM287867(US10086000, Example 84 | 6-{[(1S,3aR,4R,6aR)-4- et...)
Affinity DataIC50: 56nMAssay 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
Go to US Patent