BDBM340903 US9765054, Compound 56e

SMILES: ONC(=O)[C@@H]1[C@@H]([C@H]1c1ccc(cc1)N1CC2(COC2)C1)c1ccccc1

InChI Key: InChIKey=YJQZJJWJCFWGMO-GUDVDZBRSA-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 = 340903   

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))	BDBM340903 (US9765054, Compound 56e) Show SMILES ONC(=O)[C@@H]1[C@@H]([C@H]1c1ccc(cc1)N1CC2(COC2)C1)c1ccccc1 Show InChI InChI=1S/C21H22N2O3/c24-20(22-25)19-17(14-4-2-1-3-5-14)18(19)15-6-8-16(9-7-15)23-10-21(11-23)12-26-13-21/h1-9,17-19,25H,10-13H2,(H,22,24)/t17-,18-,19-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	150	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