BDBM504536 (S)-1-(2,3-Difluoro-4-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)phenyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one::US11066396, Example 12

SMILES Cc1noc(n1)[C@@H]1CCC(=O)N1c1ccc(-c2noc(n2)C(F)(F)F)c(F)c1F

InChI Key InChIKey=QLCZIIXOTCUYJO-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 504536   

TargetHistone deacetylase 5(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM504536((S)-1-(2,3-Difluoro-4-(5-(trifluoromethyl)-1,2,4-o...)
Affinity DataIC50: 11nMAssay Description:HDAC5 reagents: N-terminal GST tagged HDAC5 was purchased from BPS Bioscience [catalog #50045]. Assays were performed with buffer containing 20 mM HE...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2021
Entry Details
US Patent

TargetHistone deacetylase 6(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM504536((S)-1-(2,3-Difluoro-4-(5-(trifluoromethyl)-1,2,4-o...)
Affinity DataIC50: 14nMAssay Description:HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2021
Entry Details
US Patent

TargetHistone deacetylase 1(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM504536((S)-1-(2,3-Difluoro-4-(5-(trifluoromethyl)-1,2,4-o...)
Affinity DataIC50: 2.00E+3nMAssay Description:HDAC1 and 6 reagents: FLAG-tagged HDACs 1 and 6 were prepared in-house by protein expression in HEK293F cells followed by anti-FLAG affinity purifica...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2021
Entry Details
US Patent

TargetHistone deacetylase 8(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM504536((S)-1-(2,3-Difluoro-4-(5-(trifluoromethyl)-1,2,4-o...)
Affinity DataIC50: 6.00E+3nMAssay Description:HDAC8 reagents: HDAC8 was purchased from Enzo Life Sciences [catalog #BML-SE145]. Assays were performed with buffer containing 20 mM HEPES, pH 8.0 [B...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2021
Entry Details
US Patent