Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase 9' and Ligand = 'BDBM272086'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone deacetylase 9 (Homo sapiens (Human))	BDBM272086 ((S)-5-(3-Fluoro-2-methylphenyl)-1-(4-fluoro-2- met...) Show SMILES Cc1cc(F)ccc1-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r| Show InChI InChI=1S/C21H19F2N3O2/c1-12-8-15(22)6-7-18(12)26-19-10-21(20(27)25-28,9-14(19)11-24-26)16-4-3-5-17(23)13(16)2/h3-8,11,28H,9-10H2,1-2H3,(H,25,27)/t21-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
CHDI Foundation, Inc. US Patent					Assay Description The potency of the compounds is quantified by measuring the Histone Deacetylase 9 (HDAC9) enzymatic activity using the fluorogenic substrate, Boc-Lys...				US Patent US10457675 (2019) BindingDB Entry DOI: 10.7270/Q22J6F7J
					More data for this Ligand-Target Pair
Histone deacetylase 9 (Homo sapiens (Human))	BDBM272086 ((S)-5-(3-Fluoro-2-methylphenyl)-1-(4-fluoro-2- met...) Show SMILES Cc1cc(F)ccc1-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r| Show InChI InChI=1S/C21H19F2N3O2/c1-12-8-15(22)6-7-18(12)26-19-10-21(20(27)25-28,9-14(19)11-24-26)16-4-3-5-17(23)13(16)2/h3-8,11,28H,9-10H2,1-2H3,(H,25,27)/t21-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
CHDI Foundation, Inc. US Patent					Assay Description The potency of the compounds is quantified by measuring the Histone Deacetylase 9 (HDAC9) enzymatic activity using the fluorogenic substrate, Boc-Lys...				US Patent US10065948 (2018) BindingDB Entry DOI: 10.7270/Q2154K23
					More data for this Ligand-Target Pair