Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with all data for entry = 4261   

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
Tubulin polymerization-promoting protein (Homo sapiens (Human))	BDBM59225 (Boronic acid, cis-6 | Boronic acid, trans-6) Show SMILES COc1cc(C=Cc2ccc(OC)c(c2)B(O)O)cc(OC)c1OC |w:6.6| Show InChI InChI=1S/C18H21BO6/c1-22-15-8-7-12(9-14(15)19(20)21)5-6-13-10-16(23-2)18(25-4)17(11-13)24-3/h5-11,20-21H,1-4H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
University of Virginia					Assay Description IC50 values for inhibition of cell growth using MCF-7 cell line were obtained by measuring the amount of total cell protein with the sulforhodamine B...				Chem Biol 12: 1007-14 (2005) Article DOI: 10.1016/j.chembiol.2005.06.016 BindingDB Entry DOI: 10.7270/Q2DN43HC
					More data for this Ligand-Target Pair
Tubulin polymerization-promoting protein (Homo sapiens (Human))	BDBM50005480 ((-)-combretastatin | (Z)-3'-hydroxy-3,4,4',5-tetra...) Show SMILES COc1ccc(\C=C/c2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C18H20O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h5-11,19H,1-4H3/b6-5-	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
University of Virginia					Assay Description IC50 values for inhibition of cell growth using MCF-7 cell line were obtained by measuring the amount of total cell protein with the sulforhodamine B...				Chem Biol 12: 1007-14 (2005) Article DOI: 10.1016/j.chembiol.2005.06.016 BindingDB Entry DOI: 10.7270/Q2DN43HC
					More data for this Ligand-Target Pair
Tubulin polymerization-promoting protein (Homo sapiens (Human))	BDBM59225 (Boronic acid, cis-6 | Boronic acid, trans-6) Show SMILES COc1cc(C=Cc2ccc(OC)c(c2)B(O)O)cc(OC)c1OC |w:6.6| Show InChI InChI=1S/C18H21BO6/c1-22-15-8-7-12(9-14(15)19(20)21)5-6-13-10-16(23-2)18(25-4)17(11-13)24-3/h5-11,20-21H,1-4H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
University of Virginia					Assay Description IC50 values for inhibition of cell growth using MCF-7 cell line were obtained by measuring the amount of total cell protein with the sulforhodamine B...				Chem Biol 12: 1007-14 (2005) Article DOI: 10.1016/j.chembiol.2005.06.016 BindingDB Entry DOI: 10.7270/Q2DN43HC
					More data for this Ligand-Target Pair
Tubulin polymerization-promoting protein (Homo sapiens (Human))	BDBM59225 (Boronic acid, cis-6 | Boronic acid, trans-6) Show SMILES COc1cc(C=Cc2ccc(OC)c(c2)B(O)O)cc(OC)c1OC |w:6.6| Show InChI InChI=1S/C18H21BO6/c1-22-15-8-7-12(9-14(15)19(20)21)5-6-13-10-16(23-2)18(25-4)17(11-13)24-3/h5-11,20-21H,1-4H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Virginia					Assay Description Tubulin polymerization was followed turbidimetrically at 350nm in Beckman model DU-7400 and DU-7500 spectrophotometers equipped with electric tempera...				Chem Biol 12: 1007-14 (2005) Article DOI: 10.1016/j.chembiol.2005.06.016 BindingDB Entry DOI: 10.7270/Q2DN43HC
					More data for this Ligand-Target Pair
Tubulin polymerization-promoting protein (Homo sapiens (Human))	BDBM50005480 ((-)-combretastatin | (Z)-3'-hydroxy-3,4,4',5-tetra...) Show SMILES COc1ccc(\C=C/c2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C18H20O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h5-11,19H,1-4H3/b6-5-	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Virginia					Assay Description Tubulin polymerization was followed turbidimetrically at 350nm in Beckman model DU-7400 and DU-7500 spectrophotometers equipped with electric tempera...				Chem Biol 12: 1007-14 (2005) Article DOI: 10.1016/j.chembiol.2005.06.016 BindingDB Entry DOI: 10.7270/Q2DN43HC
					More data for this Ligand-Target Pair
Tubulin polymerization-promoting protein (Homo sapiens (Human))	BDBM59225 (Boronic acid, cis-6 | Boronic acid, trans-6) Show SMILES COc1cc(C=Cc2ccc(OC)c(c2)B(O)O)cc(OC)c1OC |w:6.6| Show InChI InChI=1S/C18H21BO6/c1-22-15-8-7-12(9-14(15)19(20)21)5-6-13-10-16(23-2)18(25-4)17(11-13)24-3/h5-11,20-21H,1-4H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Virginia					Assay Description Tubulin polymerization was followed turbidimetrically at 350nm in Beckman model DU-7400 and DU-7500 spectrophotometers equipped with electric tempera...				Chem Biol 12: 1007-14 (2005) Article DOI: 10.1016/j.chembiol.2005.06.016 BindingDB Entry DOI: 10.7270/Q2DN43HC
					More data for this Ligand-Target Pair