BDBM50261753 5-(3-aminophenyl)-N-(7-(hydroxyamino)-7-oxoheptyl)isoxazole-3-carboxamide::CHEMBL468595

SMILES: Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO

InChI Key: InChIKey=BYKMCJLDXBMWTO-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50261753   

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))	BDBM50261753 (5-(3-aminophenyl)-N-(7-(hydroxyamino)-7-oxoheptyl)...) Show SMILES Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO Show InChI InChI=1S/C17H22N4O4/c18-13-7-5-6-12(10-13)15-11-14(21-25-15)17(23)19-9-4-2-1-3-8-16(22)20-24/h5-7,10-11,24H,1-4,8-9,18H2,(H,19,23)(H,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20.7	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC1 (unknown origin) after 17 hrs				J Med Chem 51: 4370-3 (2008) Article DOI: 10.1021/jm8002894 BindingDB Entry DOI: 10.7270/Q27W6C11
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50261753 (5-(3-aminophenyl)-N-(7-(hydroxyamino)-7-oxoheptyl)...) Show SMILES Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO Show InChI InChI=1S/C17H22N4O4/c18-13-7-5-6-12(10-13)15-11-14(21-25-15)17(23)19-9-4-2-1-3-8-16(22)20-24/h5-7,10-11,24H,1-4,8-9,18H2,(H,19,23)(H,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	56.7	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC2 (unknown origin) after 17 hrs				J Med Chem 51: 4370-3 (2008) Article DOI: 10.1021/jm8002894 BindingDB Entry DOI: 10.7270/Q27W6C11
					More data for this Ligand-Target Pair
Polyamine deacetylase HDAC10 (Homo sapiens (Human))	BDBM50261753 (5-(3-aminophenyl)-N-(7-(hydroxyamino)-7-oxoheptyl)...) Show SMILES Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO Show InChI InChI=1S/C17H22N4O4/c18-13-7-5-6-12(10-13)15-11-14(21-25-15)17(23)19-9-4-2-1-3-8-16(22)20-24/h5-7,10-11,24H,1-4,8-9,18H2,(H,19,23)(H,20,22)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17.5	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC10 (unknown origin) after 17 hrs				J Med Chem 51: 4370-3 (2008) Article DOI: 10.1021/jm8002894 BindingDB Entry DOI: 10.7270/Q27W6C11
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50261753 (5-(3-aminophenyl)-N-(7-(hydroxyamino)-7-oxoheptyl)...) Show SMILES Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO Show InChI InChI=1S/C17H22N4O4/c18-13-7-5-6-12(10-13)15-11-14(21-25-15)17(23)19-9-4-2-1-3-8-16(22)20-24/h5-7,10-11,24H,1-4,8-9,18H2,(H,19,23)(H,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	938	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC8 (unknown origin) after 17 hrs				J Med Chem 51: 4370-3 (2008) Article DOI: 10.1021/jm8002894 BindingDB Entry DOI: 10.7270/Q27W6C11
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50261753 (5-(3-aminophenyl)-N-(7-(hydroxyamino)-7-oxoheptyl)...) Show SMILES Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO Show InChI InChI=1S/C17H22N4O4/c18-13-7-5-6-12(10-13)15-11-14(21-25-15)17(23)19-9-4-2-1-3-8-16(22)20-24/h5-7,10-11,24H,1-4,8-9,18H2,(H,19,23)(H,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.54	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC6 (unknown origin) after 17 hrs				J Med Chem 51: 4370-3 (2008) Article DOI: 10.1021/jm8002894 BindingDB Entry DOI: 10.7270/Q27W6C11
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM50261753 (5-(3-aminophenyl)-N-(7-(hydroxyamino)-7-oxoheptyl)...) Show SMILES Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO Show InChI InChI=1S/C17H22N4O4/c18-13-7-5-6-12(10-13)15-11-14(21-25-15)17(23)19-9-4-2-1-3-8-16(22)20-24/h5-7,10-11,24H,1-4,8-9,18H2,(H,19,23)(H,20,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.04	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC3 (unknown origin) after 17 hrs				J Med Chem 51: 4370-3 (2008) Article DOI: 10.1021/jm8002894 BindingDB Entry DOI: 10.7270/Q27W6C11
					More data for this Ligand-Target Pair