Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Pantetheinase' and Ligand = 'BDBM408848'   

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
Pantetheinase (Homo sapiens (Human))	BDBM408848 (US10364255, Ex. 40) Show SMILES C[C@H]1COc2cc(cnc2N1)C(=O)N1CCC(C1)c1ccncc1 |r| Show InChI InChI=1S/C18H20N4O2/c1-12-11-24-16-8-15(9-20-17(16)21-12)18(23)22-7-4-14(10-22)13-2-5-19-6-3-13/h2-3,5-6,8-9,12,14H,4,7,10-11H2,1H3,(H,20,21)/t12-,14?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingleheim International GmbH US Patent					Assay Description Method 1:Vanin-1 Enzymatic Assay:The test compounds are dissolved in 100% DMSO at a concentration of 10 mM and in a first step diluted in DMSO to a c...				US Patent US10364255 (2019) BindingDB Entry DOI: 10.7270/Q28S4S8N
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