Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein O-GlcNAcase' and Ligand = 'BDBM430455'   

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
Protein O-GlcNAcase (Homo sapiens (Human))	BDBM430455 (US10556902, No 65 | US11612599, Compound 65) Show SMILES CC(N1CCN(CC1)c1ccc(cn1)C(O)=O)c1ccc2CCOc2c1 Show InChI InChI=1S/C20H23N3O3/c1-14(16-3-2-15-6-11-26-18(15)12-16)22-7-9-23(10-8-22)19-5-4-17(13-21-19)20(24)25/h2-5,12-14H,6-11H2,1H3,(H,24,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description 5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...				Citation and Details BindingDB Entry DOI: 10.7270/Q28D015W
					More data for this Ligand-Target Pair
Protein O-GlcNAcase (Homo sapiens (Human))	BDBM430455 (US10556902, No 65 | US11612599, Compound 65) Show SMILES CC(N1CCN(CC1)c1ccc(cn1)C(O)=O)c1ccc2CCOc2c1 Show InChI InChI=1S/C20H23N3O3/c1-14(16-3-2-15-6-11-26-18(15)12-16)22-7-9-23(10-8-22)19-5-4-17(13-21-19)20(24)25/h2-5,12-14H,6-11H2,1H3,(H,24,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
Asceneuron SA US Patent					Assay Description 5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...				US Patent US10556902 (2020) BindingDB Entry DOI: 10.7270/Q2KK9F67
					More data for this Ligand-Target Pair