BDBM543886 (1s,3′r,6′s,7′r,11′s,12′r)-6-chloro-11′,12′-dimethyl-7′-(((9ar)-8-methyloctahydro-2h-pyrazino[1,2-a]pyrazin-2-yl)methyl)-3,4-dihydro-2h,15′h-spiro[naphthalene-1,22′-[20]oxa[13]thia[1,14]diazatetracyclo[14.7.2.0˜3,6˜0.0˜19,24˜]pent acosa[16,18,24]trien]-15′-one 13′,13′-dioxide::US11279712, Example 19

SMILES C[C@H]1CCC[C@@H](CN2CCN3CCN(C)C[C@@H]3C2)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C

InChI Key InChIKey=JSHMKNAXSIFCCQ-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 = 543886   

LigandPNGBDBM543886((1s,3′r,6′s,7′r,11′s,12...)
Affinity DataIC50: 0.532nMAssay Description:The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...More data for this Ligand-Target Pair
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Date in BDB:
7/10/2022
Entry Details
US Patent