Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5'-AMP-activated protein kinase catalytic subunit alpha-2' and Ligand = 'BDBM328271'   

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
5'-AMP-activated protein kinase catalytic subunit alpha-2 (Homo sapiens (Human))	BDBM328271 (N-(1-(4- cyanobenzyl)piperidin-4- yl)-6-(4-(4- (cy...) Show SMILES O=C(Nc1ccc(OC2CCN(CC2)C(=O)c2ccc(cn2)C(=O)NC2CCN(Cc3ccc(cc3)C#N)CC2)cc1)C1CC1 Show InChI InChI=1S/C35H38N6O4/c36-21-24-1-3-25(4-2-24)23-40-17-13-29(14-18-40)39-34(43)27-7-12-32(37-22-27)35(44)41-19-15-31(16-20-41)45-30-10-8-28(9-11-30)38-33(42)26-5-6-26/h1-4,7-12,22,26,29,31H,5-6,13-20,23H2,(H,38,42)(H,39,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	<500	n/a	n/a	n/a	n/a
Rigel Pharmaceuticals, Inc. US Patent					Assay Description Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...				US Patent US10377742 (2019) BindingDB Entry DOI: 10.7270/Q2RV0R22
					More data for this Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2 (Homo sapiens (Human))	BDBM328271 (N-(1-(4- cyanobenzyl)piperidin-4- yl)-6-(4-(4- (cy...) Show SMILES O=C(Nc1ccc(OC2CCN(CC2)C(=O)c2ccc(cn2)C(=O)NC2CCN(Cc3ccc(cc3)C#N)CC2)cc1)C1CC1 Show InChI InChI=1S/C35H38N6O4/c36-21-24-1-3-25(4-2-24)23-40-17-13-29(14-18-40)39-34(43)27-7-12-32(37-22-27)35(44)41-19-15-31(16-20-41)45-30-10-8-28(9-11-30)38-33(42)26-5-6-26/h1-4,7-12,22,26,29,31H,5-6,13-20,23H2,(H,38,42)(H,39,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	<500	n/a	n/a	n/a	n/a
Rigel Pharmaceuticals, Inc. US Patent					Assay Description Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...				US Patent US9663496 (2017) BindingDB Entry DOI: 10.7270/Q26975P8
					More data for this Ligand-Target Pair