Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase 9' and Ligand = 'BDBM272112'   

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))	BDBM272112 ((S)-2-(2-Chlorophenyl)-6-(3-fluoro-2-methylphenyl)...) Show SMILES Cc1c(F)cccc1[C@@]1(Cc2cnc(nc2C1)-c1ccccc1Cl)C(=O)NO |r| Show InChI InChI=1S/C21H17ClFN3O2/c1-12-15(6-4-8-17(12)23)21(20(27)26-28)9-13-11-24-19(25-18(13)10-21)14-5-2-3-7-16(14)22/h2-8,11,28H,9-10H2,1H3,(H,26,27)/t21-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	156	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))	BDBM272112 ((S)-2-(2-Chlorophenyl)-6-(3-fluoro-2-methylphenyl)...) Show SMILES Cc1c(F)cccc1[C@@]1(Cc2cnc(nc2C1)-c1ccccc1Cl)C(=O)NO |r| Show InChI InChI=1S/C21H17ClFN3O2/c1-12-15(6-4-8-17(12)23)21(20(27)26-28)9-13-11-24-19(25-18(13)10-21)14-5-2-3-7-16(14)22/h2-8,11,28H,9-10H2,1H3,(H,26,27)/t21-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	156	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