BDBM287809 1-[4-(5,11-dihydro-6H- pyrido[2,3-b] [1,5]benzodiazepin-6- ylcarbonyl)bicyclo[2.2.2] oct-2-en-1-yl]ethanone::US10086000, Example 27::US10508108, Example 27

SMILES CC(=O)C12CCC(CC1)(C=C2)C(=O)N1Cc2cccnc2Nc2ccccc12

InChI Key InChIKey=KZMUGPYUDXHKHK-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 287809   

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

US Patent
LigandPNGBDBM287809(1-[4-(5,11-dihydro-6H- pyrido[2,3-b] [1,5]benzodi...)
Affinity DataIC50:  1.44E+3nMAssay 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
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetIsocitrate dehydrogenase [NADP] cytoplasmic [R132H](Homo sapiens (Human))
Merck Sharp & Dohme

US Patent
LigandPNGBDBM287809(1-[4-(5,11-dihydro-6H- pyrido[2,3-b] [1,5]benzodi...)
Affinity DataIC50:  1.44E+3nMpH: 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
Ligand InfoPC cidPC sid
In DepthDetails US Patent