BDBM119709 US8685992, 37

SMILES: Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1

InChI Key: InChIKey=NCZPVKGOUNBDSF-UHFFFAOYSA-N

Data: 11 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 11 hits for monomerid = 119709   

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 1 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	332	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.84E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.83E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 5 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.64E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 11 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.66E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 7 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 9 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Histone deacetylase 10 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.55E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair
Cereblon/Histone deacetylase 6 (Homo sapiens (Human))	BDBM119709 (US8685992, 37) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.89E+3	n/a	n/a	n/a	n/a	n/a	30
Universidad del País Vasco; Ikerschem, S.L. US Patent					Assay Description The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...				US Patent US8685992 (2014) BindingDB Entry DOI: 10.7270/Q2CJ8C4X
					More data for this Ligand-Target Pair