Compile Data Set for Download or QSAR

Found 11 hits with Last Name = 'chène' and Initial = 'p'   

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
DNA helicase IV (Escherichia coli (strain K12))	BDBM50177710 ((3-acetylamino-5-oxo-5,11-dihydro-10-thia-dibenzo[...) Show SMILES CC(=O)Nc1ccc2CSc3ccc(CC(O)=O)cc3C(=O)c2c1 Show InChI InChI=1S/C18H15NO4S/c1-10(20)19-13-4-3-12-9-24-16-5-2-11(7-17(21)22)6-15(16)18(23)14(12)8-13/h2-6,8H,7,9H2,1H3,(H,19,20)(H,21,22)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for Biomedical Research Curated by ChEMBL					Assay Description Inhibition of ATPase activity of Helicase4 from Escherichia coli in presence of ATP (5x Km(ATP)) and dT25 (5x KDNA)				Bioorg Med Chem Lett 16: 923-7 (2006) Article DOI: 10.1016/j.bmcl.2005.10.110 BindingDB Entry DOI: 10.7270/Q2MS3SB8
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50295258 (CHEMBL571444 | N2-(benzo[d]thiazol-6-yl)-N6-tert-b...) Show SMILES CC(C)(C)Nc1nc(Nc2ccc3ncsc3c2)nc2nc[nH]c12 Show InChI InChI=1S/C16H17N7S/c1-16(2,3)23-14-12-13(18-7-17-12)21-15(22-14)20-9-4-5-10-11(6-9)24-8-19-10/h4-8H,1-3H3,(H3,17,18,20,21,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of ATPase activity of human topoisomerase 2 alpha				Bioorg Med Chem Lett 19: 4014-7 (2009) Article DOI: 10.1016/j.bmcl.2009.06.034 BindingDB Entry DOI: 10.7270/Q23J3D1M
					More data for this Ligand-Target Pair
DNA helicase IV (Escherichia coli (strain K12))	BDBM50177713 (2-(5-oxo-5,11-dihydro-10-thia-dibenzo[a,d]cyclohep...) Show SMILES CC(C(O)=O)c1ccc2SCc3ccccc3C(=O)c2c1 Show InChI InChI=1S/C17H14O3S/c1-10(17(19)20)11-6-7-15-14(8-11)16(18)13-5-3-2-4-12(13)9-21-15/h2-8,10H,9H2,1H3,(H,19,20)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for Biomedical Research Curated by ChEMBL					Assay Description Inhibition of ATPase activity of Helicase4 from Escherichia coli in presence of ATP (5x Km(ATP)) and dT25 (5x KDNA)				Bioorg Med Chem Lett 16: 923-7 (2006) Article DOI: 10.1016/j.bmcl.2005.10.110 BindingDB Entry DOI: 10.7270/Q2MS3SB8
					More data for this Ligand-Target Pair
DNA helicase IV (Escherichia coli (strain K12))	BDBM50177711 ((5-oxo-5,11-dihydro-10-thia-dibenzo[a,d]cyclohepte...) Show SMILES OC(=O)Cc1ccc2SCc3ccccc3C(=O)c2c1 Show InChI InChI=1S/C16H12O3S/c17-15(18)8-10-5-6-14-13(7-10)16(19)12-4-2-1-3-11(12)9-20-14/h1-7H,8-9H2,(H,17,18)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for Biomedical Research Curated by ChEMBL					Assay Description Inhibition of ATPase activity of Helicase4 from Escherichia coli in presence of ATP (5x Km(ATP)) and dT25 (5x KDNA)				Bioorg Med Chem Lett 16: 923-7 (2006) Article DOI: 10.1016/j.bmcl.2005.10.110 BindingDB Entry DOI: 10.7270/Q2MS3SB8
					More data for this Ligand-Target Pair
DNA helicase IV (Escherichia coli (strain K12))	BDBM50177711 ((5-oxo-5,11-dihydro-10-thia-dibenzo[a,d]cyclohepte...) Show SMILES OC(=O)Cc1ccc2SCc3ccccc3C(=O)c2c1 Show InChI InChI=1S/C16H12O3S/c17-15(18)8-10-5-6-14-13(7-10)16(19)12-4-2-1-3-11(12)9-20-14/h1-7H,8-9H2,(H,17,18)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for Biomedical Research Curated by ChEMBL					Assay Description Inhibition of ATPase activity of Tyr473Ala mutated Helicase4 in presence of ATP (5x Km(ATP)) and dT25 (5x KDNA)				Bioorg Med Chem Lett 16: 923-7 (2006) Article DOI: 10.1016/j.bmcl.2005.10.110 BindingDB Entry DOI: 10.7270/Q2MS3SB8
					More data for this Ligand-Target Pair
DNA helicase IV (Escherichia coli (strain K12))	BDBM50177712 ((2-methyl-5-oxo-5,11-dihydro-10-thia-dibenzo[a,d]c...) Show SMILES Cc1ccc2c(CSc3ccc(CC(O)=O)cc3C2=O)c1 Show InChI InChI=1S/C17H14O3S/c1-10-2-4-13-12(6-10)9-21-15-5-3-11(8-16(18)19)7-14(15)17(13)20/h2-7H,8-9H2,1H3,(H,18,19)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for Biomedical Research Curated by ChEMBL					Assay Description Inhibition of ATPase activity of Helicase4 from Escherichia coli in presence of ATP (5x Km(ATP)) and dT25 (5x KDNA)				Bioorg Med Chem Lett 16: 923-7 (2006) Article DOI: 10.1016/j.bmcl.2005.10.110 BindingDB Entry DOI: 10.7270/Q2MS3SB8
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50295259 (CHEMBL549357 | N2-(benzo[d]thiazol-6-yl)-N6-cycloh...) Show SMILES C1CCCC(CC1)Nc1nc(Nc2ccc3ncsc3c2)nc2nc[nH]c12 Show InChI InChI=1S/C19H21N7S/c1-2-4-6-12(5-3-1)23-18-16-17(21-10-20-16)25-19(26-18)24-13-7-8-14-15(9-13)27-11-22-14/h7-12H,1-6H2,(H3,20,21,23,24,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of ATPase activity of human topoisomerase 2 alpha				Bioorg Med Chem Lett 19: 4014-7 (2009) Article DOI: 10.1016/j.bmcl.2009.06.034 BindingDB Entry DOI: 10.7270/Q23J3D1M
					More data for this Ligand-Target Pair
Protein Mdm4 (Homo sapiens (Human))	BDBM50382115 (CHEMBL2024321) Show SMILES CC(C)CCn1cnc(c1-c1c[nH]c2cc(Cl)ccc12)-c1ccccc1 |(26.69,2.13,;27.47,.8,;26.7,-.54,;29.01,.81,;29.78,-.52,;31.32,-.52,;32.22,.74,;33.69,.27,;33.7,-1.27,;32.24,-1.76,;31.77,-3.23,;32.69,-4.48,;31.78,-5.74,;30.31,-5.27,;28.96,-6.04,;27.63,-5.27,;26.3,-6.04,;27.63,-3.73,;28.96,-2.95,;30.3,-3.72,;34.95,-2.17,;34.8,-3.7,;36.05,-4.59,;37.45,-3.95,;37.6,-2.41,;36.35,-1.52,)| Show InChI InChI=1S/C22H22ClN3/c1-15(2)10-11-26-14-25-21(16-6-4-3-5-7-16)22(26)19-13-24-20-12-17(23)8-9-18(19)20/h3-9,12-15,24H,10-11H2,1-2H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of p53 derived peptide binding to MDM4 using fluorescent dye Cy5 by TR-FRET assay				Bioorg Med Chem Lett 22: 3498-502 (2012) Article DOI: 10.1016/j.bmcl.2012.03.083 BindingDB Entry DOI: 10.7270/Q2D21ZM2
					More data for this Ligand-Target Pair
Protein Mdm4 (Homo sapiens (Human))	BDBM50382117 (CHEMBL2024323) Show SMILES Clc1ccc(Cn2cnc(c2-c2c([nH]c3cc(Cl)ccc23)C(=O)NCCN2CCOCC2)-c2ccccc2)cc1 |(10.77,-10.99,;11.55,-12.32,;13.09,-12.32,;13.86,-13.64,;13.1,-14.98,;13.87,-16.31,;15.41,-16.3,;16.31,-15.05,;17.78,-15.52,;17.79,-17.06,;16.33,-17.55,;15.55,-18.88,;16.18,-20.3,;15.02,-21.33,;13.68,-20.55,;12.21,-21.02,;11.07,-19.97,;9.6,-20.44,;11.41,-18.47,;12.87,-18,;14.01,-19.04,;17.68,-20.62,;18.72,-19.48,;18.16,-22.09,;19.66,-22.41,;20.13,-23.88,;21.64,-24.21,;22.1,-25.67,;23.6,-26,;24.64,-24.87,;24.17,-23.4,;22.66,-23.06,;19.13,-17.81,;19.14,-19.35,;20.48,-20.11,;21.81,-19.32,;21.79,-17.77,;20.45,-17.02,;11.56,-14.99,;10.78,-13.67,)| Show InChI InChI=1S/C31H29Cl2N5O2/c32-23-8-6-21(7-9-23)19-38-20-35-28(22-4-2-1-3-5-22)30(38)27-25-11-10-24(33)18-26(25)36-29(27)31(39)34-12-13-37-14-16-40-17-15-37/h1-11,18,20,36H,12-17,19H2,(H,34,39)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of p53 derived peptide binding to MDM4 using fluorescent dye Cy5 by TR-FRET assay				Bioorg Med Chem Lett 22: 3498-502 (2012) Article DOI: 10.1016/j.bmcl.2012.03.083 BindingDB Entry DOI: 10.7270/Q2D21ZM2
					More data for this Ligand-Target Pair
Protein Mdm4 (Homo sapiens (Human))	BDBM50382116 (CHEMBL2024322) Show SMILES Clc1ccc(Cn2cnc(c2-c2c[nH]c3cc(Cl)ccc23)-c2ccccc2)cc1 |(-5.67,-10.82,;-4.9,-12.15,;-3.35,-12.14,;-2.58,-13.47,;-3.35,-14.81,;-2.57,-16.14,;-1.03,-16.13,;-.13,-14.88,;1.33,-15.35,;1.34,-16.89,;-.12,-17.38,;-.59,-18.85,;.33,-20.1,;-.57,-21.36,;-2.05,-20.89,;-3.39,-21.66,;-4.73,-20.89,;-6.06,-21.66,;-4.72,-19.34,;-3.39,-18.57,;-2.06,-19.34,;2.6,-17.79,;2.44,-19.31,;3.7,-20.21,;5.1,-19.57,;5.24,-18.03,;3.99,-17.14,;-4.88,-14.82,;-5.66,-13.5,)| Show InChI InChI=1S/C24H17Cl2N3/c25-18-8-6-16(7-9-18)14-29-15-28-23(17-4-2-1-3-5-17)24(29)21-13-27-22-12-19(26)10-11-20(21)22/h1-13,15,27H,14H2	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD 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
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of p53 derived peptide binding to MDM4 using fluorescent dye Cy5 by TR-FRET assay				Bioorg Med Chem Lett 22: 3498-502 (2012) Article DOI: 10.1016/j.bmcl.2012.03.083 BindingDB Entry DOI: 10.7270/Q2D21ZM2
					More data for this Ligand-Target Pair
Protein Mdm4 (Homo sapiens (Human))	BDBM50382114 (CHEMBL2024320) Show SMILES COc1ccc(Cn2c(C)nc(Cc3ccc(N)cc3)c2Cc2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C26H26ClN3O/c1-18-29-25(15-19-5-11-23(28)12-6-19)26(16-20-3-9-22(27)10-4-20)30(18)17-21-7-13-24(31-2)14-8-21/h3-14H,15-17,28H2,1-2H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of p53 derived peptide binding to MDM4 using fluorescent dye Cy5 by TR-FRET assay				Bioorg Med Chem Lett 22: 3498-502 (2012) Article DOI: 10.1016/j.bmcl.2012.03.083 BindingDB Entry DOI: 10.7270/Q2D21ZM2
					More data for this Ligand-Target Pair