BDBM433074 5-cyclopropyl-N-((1R,3r,5S)-8-(((1-(4- fluorobenzyl)piperidin-4- yl)methyl)sulfonyl)-8- azabicyclo[3.2.1]octan-3-yl)isoxazole-3- carboxamide::US10577363, Compound 778

SMILES Fc1ccc(CN2CCC(CS(=O)(=O)N3[C@H]4CC[C@@H]3C[C@@H](C4)NC(=O)c3cc(on3)C3CC3)CC2)cc1

InChI Key InChIKey=FDRKWFJVVMVUKT-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 433074   

TargetHistone-lysine N-methyltransferase SMYD3(Human)
Epizyme

US Patent
LigandPNGBDBM433074(US10577363, Compound 778 | 5-cyclopropyl-N-((1R,3r...)
Affinity DataIC50: 1.18nMAssay Description:The assays were all performed in a buffer consisting of 25 mM Tris-Cl pH 8.0, 1 mM TCEP, 0.005% BSG, and 0.005% Tween 20, prepared on the day of use....More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2020
Entry Details
US Patent