BDBM192511 US9187477, 7

SMILES: CCNC(=O)O[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1nc2[nH]c(O[C@@H]3COC4[C@H](O)COC34)nc2cc1Cl

InChI Key:

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 192511   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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-1 (Homo sapiens (Human))	BDBM192511 (US9187477, 7) Show SMILES CCNC(=O)O[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1nc2[nH]c(O[C@@H]3COC4[C@H](O)COC34)nc2cc1Cl |r,wU:9.12,24.25,28.30,wD:6.5,(-12.36,6.35,;-11.03,5.58,;-11.03,4.04,;-9.69,3.27,;-9.69,1.73,;-8.36,4.04,;-7.03,3.27,;-7.03,1.73,;-5.69,.96,;-4.36,1.73,;-4.36,3.27,;-5.69,4.04,;-3.31,1.01,;-1.98,1.78,;-.65,1.01,;-.65,-.53,;-1.98,-1.3,;-3.31,-.53,;.69,-1.3,;2.02,-.53,;3.35,-1.3,;4.82,-.82,;5.72,-2.07,;7.26,-2.07,;8.03,-3.4,;7.56,-4.87,;8.8,-5.77,;10.05,-4.87,;11.59,-4.87,;12.36,-6.2,;12.07,-3.4,;10.82,-2.5,;9.57,-3.4,;4.82,-3.31,;3.35,-2.84,;2.02,-3.61,;.69,-2.84,;-.65,-3.61,)| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	n/a	n/a	468	n/a	n/a	7.0	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Activated AMPK complex 1 (containing alphal betalgammal ) was obtained from baculovirus expression system. The gene encoding AMPK alphal was cloned i...				US Patent US9187477 (2015) BindingDB Entry DOI: 10.7270/Q2CR5S58
					More data for this Ligand-Target Pair