BDBM50084940 CHEMBL3427380

SMILES: COC(=O)c1oc2c(OC)cccc2c1Nc1cc(OC)c(OC)c(OC)c1

InChI Key: InChIKey=VOYAGLZZVIVSON-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 = 50084940   

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
Similar to alpha-tubulin isoform 1 (Bos taurus)	BDBM50084940 (CHEMBL3427380) Show SMILES COC(=O)c1oc2c(OC)cccc2c1Nc1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C20H21NO7/c1-23-13-8-6-7-12-16(19(20(22)27-5)28-17(12)13)21-11-9-14(24-2)18(26-4)15(10-11)25-3/h6-10,21H,1-5H3	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Ferrara Curated by ChEMBL					Assay Description Inhibition of bovine brain tubulin assembly after 20 mins incubation by spectrophotometric analysis				J Med Chem 58: 3209-22 (2015) Article DOI: 10.1021/acs.jmedchem.5b00155 BindingDB Entry DOI: 10.7270/Q2QV3P6V
					More data for this Ligand-Target Pair