Compile Data Set for Download or QSAR

Found 10 hits Enz. Inhib. hit(s) with all data for entry = 50048499   

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 alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095321 (2-Methoxy-5-(3,4,5-trimethoxy-benzyloxy)-benzaldeh...) Show SMILES COc1ccc(OCc2cc(OC)c(OC)c(OC)c2)cc1C=O Show InChI InChI=1S/C18H20O6/c1-20-15-6-5-14(9-13(15)10-19)24-11-12-7-16(21-2)18(23-4)17(8-12)22-3/h5-10H,11H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095321 (2-Methoxy-5-(3,4,5-trimethoxy-benzyloxy)-benzaldeh...) Show SMILES COc1ccc(OCc2cc(OC)c(OC)c(OC)c2)cc1C=O Show InChI InChI=1S/C18H20O6/c1-20-15-6-5-14(9-13(15)10-19)24-11-12-7-16(21-2)18(23-4)17(8-12)22-3/h5-10H,11H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095317 (2-Methoxy-5-(3,4,5-trimethoxy-phenoxymethyl)-pheno...) Show SMILES COc1ccc(COc2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C17H20O6/c1-19-14-6-5-11(7-13(14)18)10-23-12-8-15(20-2)17(22-4)16(9-12)21-3/h5-9,18H,10H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095326 (2-Methoxy-5-(3,4,5-trimethoxy-phenoxy)-phenol | CH...) Show SMILES COc1ccc(Oc2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C16H18O6/c1-18-13-6-5-10(7-12(13)17)22-11-8-14(19-2)16(21-4)15(9-11)20-3/h5-9,17H,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095320 (2-Methoxy-5-(3,4,5-trimethoxy-benzyloxy)-phenol | ...) Show SMILES COc1ccc(OCc2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C17H20O6/c1-19-14-6-5-12(9-13(14)18)23-10-11-7-15(20-2)17(22-4)16(8-11)21-3/h5-9,18H,10H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095326 (2-Methoxy-5-(3,4,5-trimethoxy-phenoxy)-phenol | CH...) Show SMILES COc1ccc(Oc2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C16H18O6/c1-18-13-6-5-10(7-12(13)17)22-11-8-14(19-2)16(21-4)15(9-11)20-3/h5-9,17H,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095317 (2-Methoxy-5-(3,4,5-trimethoxy-phenoxymethyl)-pheno...) Show SMILES COc1ccc(COc2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C17H20O6/c1-19-14-6-5-11(7-13(14)18)10-23-12-8-15(20-2)17(22-4)16(9-12)21-3/h5-9,18H,10H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095319 (2-Methoxy-5-(3,4,5-trimethoxy-phenylamino)-phenol ...) Show SMILES COc1ccc(Nc2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C16H19NO5/c1-19-13-6-5-10(7-12(13)18)17-11-8-14(20-2)16(22-4)15(9-11)21-3/h5-9,17-18H,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095320 (2-Methoxy-5-(3,4,5-trimethoxy-benzyloxy)-phenol | ...) Show SMILES COc1ccc(OCc2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C17H20O6/c1-19-14-6-5-12(9-13(14)18)23-10-11-7-15(20-2)17(22-4)16(8-11)21-3/h5-9,18H,10H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.26E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair
Tubulin alpha-1A/beta chain (Sus scrofa (Pig))	BDBM50095319 (2-Methoxy-5-(3,4,5-trimethoxy-phenylamino)-phenol ...) Show SMILES COc1ccc(Nc2cc(OC)c(OC)c(OC)c2)cc1O Show InChI InChI=1S/C16H19NO5/c1-19-13-6-5-10(7-12(13)18)17-11-8-14(20-2)16(22-4)15(9-11)21-3/h5-9,17-18H,1-4H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.98E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Manchester Curated by ChEMBL					Assay Description Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.				Bioorg Med Chem Lett 11: 51-4 (2001) BindingDB Entry DOI: 10.7270/Q2C82CHT
					More data for this Ligand-Target Pair