BDBM432978 N-((2R,4S,5R)-1-((3- (benzylamino)propyl)sulfonyl)-2,5- dimethylpiperidin-4-yl)-5- cyclopropylisoxazole-3-carboxamide::US10577363, Compound 681

SMILES C[C@@H]1CN([C@H](C)C[C@@H]1NC(=O)c1cc(on1)C1CC1)S(=O)(=O)CCCNCc1ccccc1

InChI Key InChIKey=HLDGUIXNYGULPQ-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 432978   

TargetHistone-lysine N-methyltransferase SMYD3(Human)
Epizyme

US Patent
LigandPNGBDBM432978(US10577363, Compound 681 | N-((2R,4S,5R)-1-((3- (b...)
Affinity DataIC50: 120nMAssay 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