Compile Data Set for Download or QSAR

Found 21 hits with Last Name = 'drujon' and Initial = 't'   

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
Fatty acid synthase (Homo sapiens (Human))	BDBM50142501 ((+/-)-2-amino-4-(((2S,3S,4R,5R)-5-(6-amino-9H-puri...) Show SMILES NC(CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O Show InChI InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6?,7-,9-,10-,13-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50142502 (2-Amino-4-[(2S,3S,4R,5R)-5-(6-amino-purin-9-yl)-3,...) Show SMILES N[C@@H](CCS(=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O Show InChI InChI=1S/C14H20N6O6S/c15-6(14(23)24)1-2-27(25)3-7-9(21)10(22)13(26-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+,27?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50142502 (2-Amino-4-[(2S,3S,4R,5R)-5-(6-amino-purin-9-yl)-3,...) Show SMILES N[C@@H](CCS(=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O Show InChI InChI=1S/C14H20N6O6S/c15-6(14(23)24)1-2-27(25)3-7-9(21)10(22)13(26-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+,27?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50142502 (2-Amino-4-[(2S,3S,4R,5R)-5-(6-amino-purin-9-yl)-3,...) Show SMILES N[C@@H](CCS(=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O Show InChI InChI=1S/C14H20N6O6S/c15-6(14(23)24)1-2-27(25)3-7-9(21)10(22)13(26-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+,27?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50142505 (2-Amino-4-[(2S,3S,4R,5R)-5-(6-amino-purin-9-yl)-3,...) Show SMILES N[C@@H](CCS(=O)(=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O Show InChI InChI=1S/C14H20N6O7S/c15-6(14(23)24)1-2-28(25,26)3-7-9(21)10(22)13(27-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50009672 (AdoHcy | CHEMBL418052 | S-(5'-adenosyl)-L-homocyst...) Show SMILES N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O Show InChI InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50142506 ((2R,3R,4S,5S)-2-(6-Amino-purin-9-yl)-5-methanesulf...) Show SMILES CS(=O)(=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C11H15N5O5S/c1-22(19,20)2-5-7(17)8(18)11(21-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.20E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50142504 ((2R,3R,4S,5S)-2-(6-Amino-purin-9-yl)-5-methanesulf...) Show SMILES CS(=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C11H15N5O4S/c1-21(19)2-5-7(17)8(18)11(20-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-,21?/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM22111 ((2R,3R,4S,5S)-2-(6-amino-9H-purin-9-yl)-5-[(methyl...) Show SMILES CSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.50E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50366942 (CHEMBL540135) Show SMILES C[S+](C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| Show InChI InChI=1S/C12H18N5O3S/c1-21(2)3-6-8(18)9(19)12(20-6)17-5-16-7-10(13)14-4-15-11(7)17/h4-6,8-9,12,18-19H,3H2,1-2H3,(H2,13,14,15)/q+1/t6-,8-,9-,12-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.50E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50291713 (((S)-3-Amino-3-carboxy-propyl)-dimethyl-sulfonium ...) Show SMILES C[S+](C)CC[C@H](N)C(O)=O |r| Show InChI InChI=1S/C6H13NO2S/c1-10(2)4-3-5(7)6(8)9/h5H,3-4,7H2,1-2H3/p+1/t5-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	1.40E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50142500 ((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...) Show SMILES CSCC[C@H](N)C(O)=O |r| Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	>1.50E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie Curated by ChEMBL					Assay Description Inhibition constant against Escherichia coli cyclopropane fatty acid synthase				Bioorg Med Chem Lett 14: 1661-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.051 BindingDB Entry DOI: 10.7270/Q26H4HZX
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50495479 (CHEMBL3109084) Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)NSc1ncccc1[N+]([O-])=O |r| Show InChI InChI=1S/C16H14N4O4S/c21-16(22)13(8-10-9-18-12-5-2-1-4-11(10)12)19-25-15-14(20(23)24)6-3-7-17-15/h1-7,9,13,18-19H,8H2,(H,21,22)/t13-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50495477 (CHEMBL3109085) Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)NSc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |r| Show InChI InChI=1S/C17H14N4O6S/c22-17(23)14(7-10-9-18-13-4-2-1-3-12(10)13)19-28-16-6-5-11(20(24)25)8-15(16)21(26)27/h1-6,8-9,14,18-19H,7H2,(H,22,23)/t14-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50495478 (CHEMBL3109076) Show SMILES OC(=O)[C@H]1[C@@H](Cc2c[nH]c3ccccc23)CCN1C(=O)c1ccc2ccccc2c1 |r| Show InChI InChI=1S/C25H22N2O3/c28-24(19-10-9-16-5-1-2-6-17(16)13-19)27-12-11-18(23(27)25(29)30)14-20-15-26-22-8-4-3-7-21(20)22/h1-10,13,15,18,23,26H,11-12,14H2,(H,29,30)/t18-,23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50495476 (CHEMBL3109078) Show SMILES OC(=O)[C@H]1[C@@H](Cc2c[nH]c3ccccc23)CCN1C(=O)c1ccccc1 |r| Show InChI InChI=1S/C21H20N2O3/c24-20(14-6-2-1-3-7-14)23-11-10-15(19(23)21(25)26)12-16-13-22-18-9-5-4-8-17(16)18/h1-9,13,15,19,22H,10-12H2,(H,25,26)/t15-,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50495480 (CHEMBL3109079) Show SMILES OC(=O)[C@@H]1[C@H](Cc2c[nH]c3ccccc23)CCN1Sc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |r| Show InChI InChI=1S/C20H18N4O6S/c25-20(26)19-12(9-13-11-21-16-4-2-1-3-15(13)16)7-8-22(19)31-18-6-5-14(23(27)28)10-17(18)24(29)30/h1-6,10-12,19,21H,7-9H2,(H,25,26)/t12-,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50495481 (CHEMBL3109077) Show SMILES OC(=O)[C@@H]1[C@H](Cc2c[nH]c3ccccc23)CCN1C(=O)c1ccccc1 |r| Show InChI InChI=1S/C21H20N2O3/c24-20(14-6-2-1-3-7-14)23-11-10-15(19(23)21(25)26)12-16-13-22-18-9-5-4-8-17(16)18/h1-9,13,15,19,22H,10-12H2,(H,25,26)/t15-,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50495482 (CHEMBL3109075) Show SMILES OC(=O)[C@@H]1[C@H](Cc2c[nH]c3ccccc23)CCN1C(=O)c1ccc2ccccc2c1 |r| Show InChI InChI=1S/C25H22N2O3/c28-24(19-10-9-16-5-1-2-6-17(16)13-19)27-12-11-18(23(27)25(29)30)14-20-15-26-22-8-4-3-7-21(20)22/h1-10,13,15,18,23,26H,11-12,14H2,(H,29,30)/t18-,23-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.28E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50495483 (CHEMBL3109080) Show SMILES OC(=O)[C@H](Cc1csc2ccccc12)N1C(=O)c2ccccc2C1=O |r| Show InChI InChI=1S/C19H13NO4S/c21-17-13-6-1-2-7-14(13)18(22)20(17)15(19(23)24)9-11-10-25-16-8-4-3-5-12(11)16/h1-8,10,15H,9H2,(H,23,24)/t15-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50389497 (CHEMBL1564869) Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)N1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C19H14N2O4/c22-17-13-6-1-2-7-14(13)18(23)21(17)16(19(24)25)9-11-10-20-15-8-4-3-5-12(11)15/h1-8,10,16,20H,9H2,(H,24,25)/t16-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Pierre et Marie Curie-Paris 6 Curated by ChEMBL					Assay Description Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...				J Med Chem 57: 421-34 (2014) Article DOI: 10.1021/jm401419p BindingDB Entry DOI: 10.7270/Q2QN69Q3
					More data for this Ligand-Target Pair