BDBM34116 hydroquinone derivative, 3b

SMILES: CCC(C)(CC)c1cc(O)c(Cc2ccc(cc2)[N+]([O-])=O)cc1O

InChI Key: InChIKey=AKQCBEDMAYVXMG-UHFFFAOYSA-N

Data: 1 IC50

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 = 34116   

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
Sarco/endoplasmic Reticulum Ca2+ ATPase 1 (Oryctolagus cuniculus)	BDBM34116 (hydroquinone derivative, 3b) Show SMILES CCC(C)(CC)c1cc(O)c(Cc2ccc(cc2)[N+]([O-])=O)cc1O Show InChI InChI=1S/C19H23NO4/c1-4-19(3,5-2)16-12-17(21)14(11-18(16)22)10-13-6-8-15(9-7-13)20(23)24/h6-9,11-12,21-22H,4-5,10H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	7.3	37
Northern Kentucky University					Assay Description Inhibitory potencies of compounds were determined in a coupled ATPase activity assay using SERCA microsomes at 14 different inhibitor concentrations....				Bioorg Med Chem 17: 6613-9 (2009) Article DOI: 10.1016/j.bmc.2009.07.075 BindingDB Entry DOI: 10.7270/Q2154FCG
					More data for this Ligand-Target Pair