Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rhomboid domain-containing protein' and Ligand = 'BDBM165196'   

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
Rhomboid domain-containing protein (Thermotoga maritima (Thermotogales))	BDBM165196 ((4S)‐4‐(pent‐4‐yn‐1&...) Show SMILES CCCCC[C@H]1[C@H](CCCC#C)OC1=O |r| Show InChI InChI=1S/C13H20O2/c1-3-5-7-9-11-12(15-13(11)14)10-8-6-4-2/h2,11-12H,3,5-10H2,1H3/t11-,12-/m0/s1	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+4	n/a	n/a	n/a	n/a	7.4	37
Technische Universität München					Assay Description We selected several inhibitor structures and determined their apparent IC50 by competitive ABPP.				ACS Chem Biol 10: 2325-33 (2015) Article DOI: 10.1021/acschembio.5b00514 BindingDB Entry DOI: 10.7270/Q2668BZ8
					More data for this Ligand-Target Pair