Compile Data Set for Download or QSAR

Found 31 hits with Last Name = 'thiede' and Initial = 'b'   

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
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216514 (4-(3-hydroxyphenyl)-7,7-dimethyl-2-thioxo-1,2,3,4,...) Show SMILES CC1(C)CC(=O)C2C(NC(=S)N=C2C1)c1cccc(O)c1 |w:7.15,c:11| Show InChI InChI=1S/C16H18N2O2S/c1-16(2)7-11-13(12(20)8-16)14(18-15(21)17-11)9-4-3-5-10(19)6-9/h3-6,13-14,19H,7-8H2,1-2H3,(H,18,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216507 (5-furanoyl-4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-...) Show SMILES CC1=NC(=S)NC(C1C(=O)c1ccco1)c1cccc(O)c1 |w:6.16,t:1| Show InChI InChI=1S/C16H14N2O3S/c1-9-13(15(20)12-6-3-7-21-12)14(18-16(22)17-9)10-4-2-5-11(19)8-10/h2-8,13-14,19H,1H3,(H,18,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216503 (4-(3-hydroxyphenyl)-2-thioxo-1,2,3,4,7,8-hexahydro...) Show SMILES Oc1cccc(c1)C1NC(=S)N=C2CCCC(=O)C12 |w:7.7,t:12| Show InChI InChI=1S/C14H14N2O2S/c17-9-4-1-3-8(7-9)13-12-10(15-14(19)16-13)5-2-6-11(12)18/h1,3-4,7,12-13,17H,2,5-6H2,(H,16,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216507 (5-furanoyl-4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-...) Show SMILES CC1=NC(=S)NC(C1C(=O)c1ccco1)c1cccc(O)c1 |w:6.16,t:1| Show InChI InChI=1S/C16H14N2O3S/c1-9-13(15(20)12-6-3-7-21-12)14(18-16(22)17-9)10-4-2-5-11(19)8-10/h2-8,13-14,19H,1H3,(H,18,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL 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
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216504 (2-acetyl-4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,...) Show SMILES CCOC(=O)C1=C(C)NC(=S)N(C1c1cccc(O)c1)C(C)=O |w:12.13,c:5| Show InChI InChI=1S/C16H18N2O4S/c1-4-22-15(21)13-9(2)17-16(23)18(10(3)19)14(13)11-6-5-7-12(20)8-11/h5-8,14,20H,4H2,1-3H3,(H,17,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in HeLa cells after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216510 (4-(3-acetoxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CCOC(=O)C1C(NC(=S)N=C1C)c1cccc(OC(C)=O)c1 |c:10| Show InChI InChI=1S/C16H18N2O4S/c1-4-21-15(20)13-9(2)17-16(23)18-14(13)11-6-5-7-12(8-11)22-10(3)19/h5-8,13-14H,4H2,1-3H3,(H,18,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in HeLa cells after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216512 (1-amino-5-[4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-...) Show SMILES CC1=NC(=S)NC(C1C(=O)NCCOCCOCCN)c1cccc(O)c1 |w:6.20,t:1| Show InChI InChI=1S/C18H26N4O4S/c1-12-15(17(24)20-6-8-26-10-9-25-7-5-19)16(22-18(27)21-12)13-3-2-4-14(23)11-13/h2-4,11,15-16,23H,5-10,19H2,1H3,(H,20,24)(H,22,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in HeLa cells after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216500 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC1=NC(=S)NC(C1C(=O)OCCOCCS)c1cccc(O)c1 |w:6.17,t:1| Show InChI InChI=1S/C16H20N2O4S2/c1-10-13(15(20)22-6-5-21-7-8-23)14(18-16(24)17-10)11-3-2-4-12(19)9-11/h2-4,9,13-14,19,23H,5-8H2,1H3,(H,18,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216501 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC(=O)SCCOCCOC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1 |w:13.20,c:17| Show InChI InChI=1S/C18H22N2O5S2/c1-11-15(17(23)25-7-6-24-8-9-27-12(2)21)16(20-18(26)19-11)13-4-3-5-14(22)10-13/h3-5,10,15-16,22H,6-9H2,1-2H3,(H,20,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216499 (CHEMBL391848 | ethyl 6-(3-acetoxyphenyl)-1-acetyl-...) Show SMILES CCOC(=O)C1=C(C)NC(=S)N(C1c1cccc(OC(C)=O)c1)C(C)=O |w:12.13,c:5| Show InChI InChI=1S/C18H20N2O5S/c1-5-24-17(23)15-10(2)19-18(26)20(11(3)21)16(15)13-7-6-8-14(9-13)25-12(4)22/h6-9,16H,5H2,1-4H3,(H,19,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in HeLa cells after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216500 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC1=NC(=S)NC(C1C(=O)OCCOCCS)c1cccc(O)c1 |w:6.17,t:1| Show InChI InChI=1S/C16H20N2O4S2/c1-10-13(15(20)22-6-5-21-7-8-23)14(18-16(24)17-10)11-3-2-4-12(19)9-11/h2-4,9,13-14,19,23H,5-8H2,1H3,(H,18,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216502 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CCOC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1 |w:6.13,c:10| Show InChI InChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,11-12,17H,3H2,1-2H3,(H,16,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in HeLa cells after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216502 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CCOC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1 |w:6.13,c:10| Show InChI InChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,11-12,17H,3H2,1-2H3,(H,16,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216511 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC1=NC(=S)NC(C1C(=O)OCCOCCO)c1cccc(O)c1 |w:6.17,t:1| Show InChI InChI=1S/C16H20N2O5S/c1-10-13(15(21)23-8-7-22-6-5-19)14(18-16(24)17-10)11-3-2-4-12(20)9-11/h2-4,9,13-14,19-20H,5-8H2,1H3,(H,18,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216505 (1,5-di-[4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2...) Show SMILES CC1=NC(=S)NC(C1C(=O)OCCOCCOC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1)c1cccc(O)c1 |w:6.36,c:25,t:1| Show InChI InChI=1S/C28H30N4O7S2/c1-15-21(23(31-27(40)29-15)17-5-3-7-19(33)13-17)25(35)38-11-9-37-10-12-39-26(36)22-16(2)30-28(41)32-24(22)18-6-4-8-20(34)14-18/h3-8,13-14,21-24,33-34H,9-12H2,1-2H3,(H,31,40)(H,32,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216501 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC(=O)SCCOCCOC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1 |w:13.20,c:17| Show InChI InChI=1S/C18H22N2O5S2/c1-11-15(17(23)25-7-6-24-8-9-27-12(2)21)16(20-18(26)19-11)13-4-3-5-14(22)10-13/h3-5,10,15-16,22H,6-9H2,1-2H3,(H,20,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.15E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216498 (4-(3-hydroxy-phenyl)-6-methyl-2-selenoxo-1,2,3,4-t...) Show SMILES CCOC(=O)C1C(NC(=[Se])N=C1C)c1cccc(O)c1 |w:6.13,c:10| Show InChI InChI=1S/C14H16N2O3Se/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,11-12,17H,3H2,1-2H3,(H,16,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.15E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216502 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CCOC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1 |w:6.13,c:10| Show InChI InChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,11-12,17H,3H2,1-2H3,(H,16,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216512 (1-amino-5-[4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-...) Show SMILES CC1=NC(=S)NC(C1C(=O)NCCOCCOCCN)c1cccc(O)c1 |w:6.20,t:1| Show InChI InChI=1S/C18H26N4O4S/c1-12-15(17(24)20-6-8-26-10-9-25-7-5-19)16(22-18(27)21-12)13-3-2-4-14(23)11-13/h2-4,11,15-16,23H,5-10,19H2,1H3,(H,20,24)(H,22,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.83E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216511 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC1=NC(=S)NC(C1C(=O)OCCOCCO)c1cccc(O)c1 |w:6.17,t:1| Show InChI InChI=1S/C16H20N2O5S/c1-10-13(15(21)23-8-7-22-6-5-19)14(18-16(24)17-10)11-3-2-4-12(20)9-11/h2-4,9,13-14,19-20H,5-8H2,1H3,(H,18,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216512 (1-amino-5-[4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-...) Show SMILES CC1=NC(=S)NC(C1C(=O)NCCOCCOCCN)c1cccc(O)c1 |w:6.20,t:1| Show InChI InChI=1S/C18H26N4O4S/c1-12-15(17(24)20-6-8-26-10-9-25-7-5-19)16(22-18(27)21-12)13-3-2-4-14(23)11-13/h2-4,11,15-16,23H,5-10,19H2,1H3,(H,20,24)(H,22,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216508 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC1=NC(=S)NC(C1C(=O)OCCOCCOCCOCCO)c1cccc(O)c1 |w:6.23,t:1| Show InChI InChI=1S/C20H28N2O7S/c1-14-17(18(22-20(30)21-14)15-3-2-4-16(24)13-15)19(25)29-12-11-28-10-9-27-8-7-26-6-5-23/h2-4,13,17-18,23-24H,5-12H2,1H3,(H,22,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216509 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CCNC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1 |w:6.13,c:10| Show InChI InChI=1S/C14H17N3O2S/c1-3-15-13(19)11-8(2)16-14(20)17-12(11)9-5-4-6-10(18)7-9/h4-7,11-12,18H,3H2,1-2H3,(H,15,19)(H,17,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216498 (4-(3-hydroxy-phenyl)-6-methyl-2-selenoxo-1,2,3,4-t...) Show SMILES CCOC(=O)C1C(NC(=[Se])N=C1C)c1cccc(O)c1 |w:6.13,c:10| Show InChI InChI=1S/C14H16N2O3Se/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,11-12,17H,3H2,1-2H3,(H,16,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216505 (1,5-di-[4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2...) Show SMILES CC1=NC(=S)NC(C1C(=O)OCCOCCOC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1)c1cccc(O)c1 |w:6.36,c:25,t:1| Show InChI InChI=1S/C28H30N4O7S2/c1-15-21(23(31-27(40)29-15)17-5-3-7-19(33)13-17)25(35)38-11-9-37-10-12-39-26(36)22-16(2)30-28(41)32-24(22)18-6-4-8-20(34)14-18/h3-8,13-14,21-24,33-34H,9-12H2,1-2H3,(H,31,40)(H,32,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216513 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC1=NC(=S)NC(C1C(O)=O)c1cccc(O)c1 |w:6.11,t:1| Show InChI InChI=1S/C12H12N2O3S/c1-6-9(11(16)17)10(14-12(18)13-6)7-3-2-4-8(15)5-7/h2-5,9-10,15H,1H3,(H,14,18)(H,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216506 (1-azido-5-[4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-...) Show SMILES CC1=NC(=S)NC(C1C(=O)NCCOCCOCCN=[N+]=[N-])c1cccc(O)c1 |w:6.22,t:1| Show InChI InChI=1S/C18H24N6O4S/c1-12-15(16(23-18(29)22-12)13-3-2-4-14(25)11-13)17(26)20-5-7-27-9-10-28-8-6-21-24-19/h2-4,11,15-16,25H,5-10H2,1H3,(H,20,26)(H,23,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216508 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC1=NC(=S)NC(C1C(=O)OCCOCCOCCOCCO)c1cccc(O)c1 |w:6.23,t:1| Show InChI InChI=1S/C20H28N2O7S/c1-14-17(18(22-20(30)21-14)15-3-2-4-16(24)13-15)19(25)29-12-11-28-10-9-27-8-7-26-6-5-23/h2-4,13,17-18,23-24H,5-12H2,1H3,(H,22,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216506 (1-azido-5-[4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-...) Show SMILES CC1=NC(=S)NC(C1C(=O)NCCOCCOCCN=[N+]=[N-])c1cccc(O)c1 |w:6.22,t:1| Show InChI InChI=1S/C18H24N6O4S/c1-12-15(16(23-18(29)22-12)13-3-2-4-14(25)11-13)17(26)20-5-7-27-9-10-28-8-6-21-24-19/h2-4,11,15-16,25H,5-10H2,1H3,(H,20,26)(H,23,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.91E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216513 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CC1=NC(=S)NC(C1C(O)=O)c1cccc(O)c1 |w:6.11,t:1| Show InChI InChI=1S/C12H12N2O3S/c1-6-9(11(16)17)10(14-12(18)13-6)7-3-2-4-8(15)5-7/h2-5,9-10,15H,1H3,(H,14,18)(H,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)
Kinesin-like protein KIF11 (Homo sapiens (Human))	BDBM50216509 (4-(3-hydroxy-phenyl)-6-methyl-2-thioxo-1,2,3,4-tet...) Show SMILES CCNC(=O)C1C(NC(=S)N=C1C)c1cccc(O)c1 |w:6.13,c:10| Show InChI InChI=1S/C14H17N3O2S/c1-3-15-13(19)11-8(2)16-14(20)17-12(11)9-5-4-6-10(18)7-9/h4-7,11-12,18H,3H2,1-2H3,(H,15,19)(H,17,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS-Université Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of microtubule-stimulated Eg5 ATPase activity expressed in Escherichia coli after 12 hrs				Bioorg Med Chem 15: 6474-88 (2007) Article DOI: 10.1016/j.bmc.2007.06.016 BindingDB Entry DOI: 10.7270/Q2X63MPM
					More data for this Ligand-Target Pair				3D Structure (docked)