null

SMILES: Cn1cc(cn1)[C@H]1[C@@H]([C@@H]1c1ccccc1)C(=O)NO

InChI Key: InChIKey=KKEQSTLHUXMHBH-JHJVBQTASA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50446477   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50446477 (CHEMBL3110023 | US9765054, Compound 25b) Show SMILES Cn1cc(cn1)[C@H]1[C@@H]([C@@H]1c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C14H15N3O2/c1-17-8-10(7-15-17)12-11(13(12)14(18)16-19)9-5-3-2-4-6-9/h2-8,11-13,19H,1H3,(H,16,18)/t11-,12-,13-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	US Patent	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
CHDI Foundation, Inc. US Patent					Assay Description 5 μl of each solution of 1:20 diluted compound from above is transferred to a clear bottomed, black, 384-well assay plate using the Bravo or the...				US Patent US9765054 (2017) BindingDB Entry DOI: 10.7270/Q2XW4MZG
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM50446477 (CHEMBL3110023 | US9765054, Compound 25b) Show SMILES Cn1cc(cn1)[C@H]1[C@@H]([C@@H]1c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C14H15N3O2/c1-17-8-10(7-15-17)12-11(13(12)14(18)16-19)9-5-3-2-4-6-9/h2-8,11-13,19H,1H3,(H,16,18)/t11-,12-,13-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
BioFocus Curated by ChEMBL					Assay Description Inhibition of human recombinant full length HDAC3-NCoR2 using Lys_Ac_AMC as substrate after 60 mins by fluorescence assay				J Med Chem 56: 9934-54 (2013) Article DOI: 10.1021/jm4011884 BindingDB Entry DOI: 10.7270/Q2DZ09RK
					More data for this Ligand-Target Pair