BDBM340955 US9765054, Compound 77

SMILES: Cc1cnc(nc1)-c1cccc(c1)[C@H]1[C@@H]([C@@H]1c1ccccc1)C(=O)NO

InChI Key: InChIKey=PBOHUUXKBWVPSL-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 = 340955   

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))	BDBM340955 (US9765054, Compound 77) Show SMILES Cc1cnc(nc1)-c1cccc(c1)[C@H]1[C@@H]([C@@H]1c1ccccc1)C(=O)NO Show InChI InChI=1S/C21H19N3O2/c1-13-11-22-20(23-12-13)16-9-5-8-15(10-16)18-17(19(18)21(25)24-26)14-6-3-2-4-7-14/h2-12,17-19,26H,1H3,(H,24,25)/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	160	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