Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50568210'   

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 1 (Homo sapiens (Human))	BDBM50568210 (CHEMBL4863325) Show SMILES CCC(=O)CCCCC[C@@H]1NC(=O)[C@H]2CC22CCN(CC2)CCCCCn2c3ccc(cc3ccc2=O)-c2cnc1o2 |r,wU:13.12,wD:9.8,(24.65,-55.17,;23.25,-54.53,;22.01,-55.41,;22.14,-56.95,;20.6,-54.78,;19.35,-55.67,;17.96,-55.03,;16.7,-55.92,;15.31,-55.28,;14.05,-56.17,;14.2,-57.69,;15.59,-58.35,;16.85,-57.45,;15.75,-59.86,;16.63,-61.12,;15.1,-61.25,;13.72,-60.47,;12.36,-61.25,;12.36,-62.84,;13.73,-63.63,;15.12,-62.84,;6.84,-61.59,;5.26,-61.91,;4.2,-60.71,;4.71,-59.19,;3.65,-57.99,;4.16,-56.46,;5.67,-56.16,;6.69,-57.32,;8.2,-57.01,;8.69,-55.55,;7.67,-54.4,;6.17,-54.68,;5.15,-53.52,;3.62,-53.82,;3.13,-55.3,;1.55,-55.62,;10.19,-55.25,;10.83,-53.85,;12.36,-54.03,;12.66,-55.53,;11.32,-56.28,)| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC1 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2021.128168 BindingDB Entry DOI: 10.7270/Q2QR51V7
					More data for this Ligand-Target Pair