BDBM50170569 (2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophen-3-yl)-(3,4,5-trimethoxy-phenyl)-methanone::CHEMBL362315

SMILES: COc1cc(cc(OC)c1OC)C(=O)c1c(N)sc2CCCCc12

InChI Key: InChIKey=UFCXZXHZPWSXTE-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 = 50170569   

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
Beta tubulin (Leishmania donovani)	BDBM50170569 ((2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophen-3-yl)...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)c1c(N)sc2CCCCc12 Show InChI InChI=1S/C18H21NO4S/c1-21-12-8-10(9-13(22-2)17(12)23-3)16(20)15-11-6-4-5-7-14(11)24-18(15)19/h8-9H,4-7,19H2,1-3H3	GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universitá di Ferrara Curated by ChEMBL					Assay Description Concentration required to inhibit tubulin polymerization at 10 uM				Bioorg Med Chem Lett 15: 4048-52 (2005) Article DOI: 10.1016/j.bmcl.2005.06.022 BindingDB Entry DOI: 10.7270/Q2XP74GG
					More data for this Ligand-Target Pair