BDBM34137 4,4-butane-2,3-diyldiphenol, 8

SMILES: CC(C(C)c1ccc(O)cc1)c1ccc(O)cc1

InChI Key: InChIKey=GDUYFVYTXYOMSJ-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 1 PDB ID contains this monomer as substructures. 1 PDB ID contains inhibitors having a similarity of 90% to this monomer.

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 = 34137   

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)	BDBM34137 (4,4-butane-2,3-diyldiphenol, 8) Show SMILES CC(C(C)c1ccc(O)cc1)c1ccc(O)cc1 Show InChI InChI=1S/C16H18O2/c1-11(13-3-7-15(17)8-4-13)12(2)14-5-9-16(18)10-6-14/h3-12,17-18H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.83E+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: 1353-60 (2009) Article DOI: 10.1016/j.bmc.2008.12.010 BindingDB Entry DOI: 10.7270/Q2WD3XX7
					More data for this Ligand-Target Pair