BDBM340912 US9765054, Compound 56h

SMILES: ONC(=O)[C@@H]1[C@@H]([C@H]1c1cccc(c1)N1CCCn2nccc12)c1ccccc1

InChI Key: InChIKey=KMAGHTJQITVHSQ-NJDAHSKKSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 340912   

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))	BDBM340912 (US9765054, Compound 56h) Show SMILES ONC(=O)[C@@H]1[C@@H]([C@H]1c1cccc(c1)N1CCCn2nccc12)c1ccccc1 Show InChI InChI=1S/C22H22N4O2/c27-22(24-28)21-19(15-6-2-1-3-7-15)20(21)16-8-4-9-17(14-16)25-12-5-13-26-18(25)10-11-23-26/h1-4,6-11,14,19-21,28H,5,12-13H2,(H,24,27)/t19-,20-,21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	170	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