Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Similar to alpha-tubulin isoform 1' and Ligand = 'BDBM50473487'   

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
Similar to alpha-tubulin isoform 1 (Bos taurus)	BDBM50473487 (CHEMBL336919) Show SMILES COc1ccc(CNc2nc(NCc3ccc(OC)cc3)c3ncn(C4CCC(O)CC4)c3n2)cc1 |(-.37,-14,;-.37,-12.46,;.97,-11.69,;2.29,-12.46,;3.64,-11.69,;3.64,-10.15,;4.95,-9.37,;4.95,-7.83,;6.27,-7.04,;6.27,-5.52,;7.58,-4.73,;7.58,-3.19,;8.9,-2.42,;10.44,-2.42,;11.2,-1.07,;12.74,-1.07,;13.52,-2.41,;15.06,-2.38,;15.83,-3.72,;12.75,-3.73,;11.21,-3.73,;8.93,-5.5,;10.39,-5.02,;11.3,-6.26,;10.41,-7.51,;10.89,-8.96,;12.39,-9.25,;12.88,-10.73,;11.85,-11.88,;12.32,-13.35,;10.34,-11.56,;9.86,-10.11,;8.93,-7.04,;7.61,-7.81,;2.29,-9.38,;.97,-10.15,)| Show InChI InChI=1S/C27H32N6O3/c1-35-22-11-3-18(4-12-22)15-28-25-24-26(33(17-30-24)20-7-9-21(34)10-8-20)32-27(31-25)29-16-19-5-13-23(36-2)14-6-19/h3-6,11-14,17,20-21,34H,7-10,15-16H2,1-2H3,(H2,28,29,31,32)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
New York University Curated by ChEMBL					Assay Description Inhibition of tubulin polymerization using bovine brain tubulin				J Med Chem 44: 4497-500 (2001) Article DOI: 10.1021/jm010451+ BindingDB Entry DOI: 10.7270/Q2XW4NJH
					More data for this Ligand-Target Pair