Compile Data Set for Download or QSAR
Found 94 Enz. Inhib. hit(s) with all data for entry = 2148
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17428(1,2,4-Triazole Compound, 86 | N-[5-(benzylsulfanyl...)
Show SMILES C(Sc1nnc(Nc2cccnc2)[nH]1)c1ccccc1
Show InChI InChI=1S/C14H13N5S/c1-2-5-11(6-3-1)10-20-14-17-13(18-19-14)16-12-7-4-8-15-9-12/h1-9H,10H2,(H2,16,17,18,19)
Affinity DataKi:  0.0400nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17355(1,2,4-Triazole Compound, 13 | 5-(benzylsulfanyl)-N...)
Show SMILES Cc1ccccc1Nc1nnc(SCc2ccccc2)[nH]1
Show InChI InChI=1S/C16H16N4S/c1-12-7-5-6-10-14(12)17-15-18-16(20-19-15)21-11-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H2,17,18,19,20)
Affinity DataKi:  0.0400nM ΔG°:  -58.8kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17388(1,2,4-Triazole Compound, 46 | 5-(benzylsulfanyl)-N...)
Show SMILES COc1ccc(Nc2nnc(SCc3ccccc3)[nH]2)cc1
Show InChI InChI=1S/C16H16N4OS/c1-21-14-9-7-13(8-10-14)17-15-18-16(20-19-15)22-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,17,18,19,20)
Affinity DataKi:  0.0500nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17365(1,2,4-Triazole Compound, 23 | 5-(benzylsulfanyl)-N...)
Show SMILES Cc1ccc(Nc2nnc(SCc3ccccc3)[nH]2)cc1
Show InChI InChI=1S/C16H16N4S/c1-12-7-9-14(10-8-12)17-15-18-16(20-19-15)21-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H2,17,18,19,20)
Affinity DataKi:  0.0700nM ΔG°:  -57.4kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17390(1,2,4-Triazole Compound, 48 | 5-{[(2-fluorophenyl)...)
Show SMILES COc1ccc(Nc2nnc(SCc3ccccc3F)[nH]2)cc1
Show InChI InChI=1S/C16H15FN4OS/c1-22-13-8-6-12(7-9-13)18-15-19-16(21-20-15)23-10-11-4-2-3-5-14(11)17/h2-9H,10H2,1H3,(H2,18,19,20,21)
Affinity DataKi:  0.130nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17362(1,2,4-Triazole Compound, 20 | 5-[(3-methylbut-2-en...)
Show SMILES CC(C)=CCSc1nnc(Nc2ccccc2C)[nH]1
Show InChI InChI=1S/C14H18N4S/c1-10(2)8-9-19-14-16-13(17-18-14)15-12-7-5-4-6-11(12)3/h4-8H,9H2,1-3H3,(H2,15,16,17,18)
Affinity DataKi:  0.150nM ΔG°:  -55.5kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17395(1,2,4-Triazole Compound, 53 | N-(4-methoxyphenyl)-...)
Show SMILES COc1ccc(Nc2nnc(SCC=C(C)C)[nH]2)cc1
Show InChI InChI=1S/C14H18N4OS/c1-10(2)8-9-20-14-16-13(17-18-14)15-11-4-6-12(19-3)7-5-11/h4-8H,9H2,1-3H3,(H2,15,16,17,18)
Affinity DataKi:  0.160nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17358(1,2,4-Triazole Compound, 16 | 5-{[(2-fluorophenyl)...)
Show SMILES Cc1ccccc1Nc1nnc(SCc2ccccc2F)[nH]1
Show InChI InChI=1S/C16H15FN4S/c1-11-6-2-5-9-14(11)18-15-19-16(21-20-15)22-10-12-7-3-4-8-13(12)17/h2-9H,10H2,1H3,(H2,18,19,20,21)
Affinity DataKi:  0.230nM ΔG°:  -54.5kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17430(1,2,4-Triazole Compound, 88 | N-(5-{[(2-fluorophen...)
Show SMILES Fc1ccccc1CSc1nnc(Nc2cccnc2)[nH]1
Show InChI InChI=1S/C14H12FN5S/c15-12-6-2-1-4-10(12)9-21-14-18-13(19-20-14)17-11-5-3-7-16-8-11/h1-8H,9H2,(H2,17,18,19,20)
Affinity DataKi:  0.300nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17411(1,2,4-Triazole Compound, 69 | methyl 4-[(5-{[(2-fl...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCc3ccccc3F)[nH]2)cc1
Show InChI InChI=1S/C17H15FN4O2S/c1-24-15(23)11-6-8-13(9-7-11)19-16-20-17(22-21-16)25-10-12-4-2-3-5-14(12)18/h2-9H,10H2,1H3,(H2,19,20,21,22)
Affinity DataKi:  0.410nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17377(1,2,4-Triazole Compound, 35 | 5-(benzylsulfanyl)-N...)
Show SMILES Clc1ccc(Nc2nnc(SCc3ccccc3)[nH]2)cc1
Show InChI InChI=1S/C15H13ClN4S/c16-12-6-8-13(9-7-12)17-14-18-15(20-19-14)21-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,17,18,19,20)
Affinity DataKi:  0.430nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17431(1,2,4-Triazole Compound, 89 | N-(5-{[(3,4-difluoro...)
Show SMILES Fc1ccc(CSc2nnc(Nc3cccnc3)[nH]2)cc1F
Show InChI InChI=1S/C14H11F2N5S/c15-11-4-3-9(6-12(11)16)8-22-14-19-13(20-21-14)18-10-2-1-5-17-7-10/h1-7H,8H2,(H2,18,19,20,21)
Affinity DataKi:  0.5nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17352(1,2,4-Triazole Compound, 6 | 5-(benzylsulfanyl)-N-...)
Show SMILES C(Sc1nnc(Nc2ccccc2)[nH]1)c1ccccc1
Show InChI InChI=1S/C15H14N4S/c1-3-7-12(8-4-1)11-20-15-17-14(18-19-15)16-13-9-5-2-6-10-13/h1-10H,11H2,(H2,16,17,18,19)
Affinity DataKi:  0.5nM ΔG°:  -52.6kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17416(1,2,4-Triazole Compound, 74 | methyl 4-({5-[(3-met...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCC=C(C)C)[nH]2)cc1
Show InChI InChI=1S/C15H18N4O2S/c1-10(2)8-9-22-15-17-14(18-19-15)16-12-6-4-11(5-7-12)13(20)21-3/h4-8H,9H2,1-3H3,(H2,16,17,18,19)
Affinity DataKi:  0.5nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17385(1,2,4-Triazole Compound, 43 | N-(4-chlorophenyl)-5...)
Show SMILES CC(C)=CCSc1nnc(Nc2ccc(Cl)cc2)[nH]1
Show InChI InChI=1S/C13H15ClN4S/c1-9(2)7-8-19-13-16-12(17-18-13)15-11-5-3-10(14)4-6-11/h3-7H,8H2,1-2H3,(H2,15,16,17,18)
Affinity DataKi:  0.520nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17380(1,2,4-Triazole Compound, 38 | N-(4-chlorophenyl)-5...)
Show SMILES Fc1ccccc1CSc1nnc(Nc2ccc(Cl)cc2)[nH]1
Show InChI InChI=1S/C15H12ClFN4S/c16-11-5-7-12(8-6-11)18-14-19-15(21-20-14)22-9-10-3-1-2-4-13(10)17/h1-8H,9H2,(H2,18,19,20,21)
Affinity DataKi:  0.610nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17368(1,2,4-Triazole Compound, 26 | 5-{[(2-fluorophenyl)...)
Show SMILES Cc1ccc(Nc2nnc(SCc3ccccc3F)[nH]2)cc1
Show InChI InChI=1S/C16H15FN4S/c1-11-6-8-13(9-7-11)18-15-19-16(21-20-15)22-10-12-4-2-3-5-14(12)17/h2-9H,10H2,1H3,(H2,18,19,20,21)
Affinity DataKi:  0.650nM ΔG°:  -51.9kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17408(1,2,4-Triazole Compound, 66 | methyl 4-{[5-(benzyl...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCc3ccccc3)[nH]2)cc1
Show InChI InChI=1S/C17H16N4O2S/c1-23-15(22)13-7-9-14(10-8-13)18-16-19-17(21-20-16)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,18,19,20,21)
Affinity DataKi:  0.700nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17354(1,2,4-Triazole Compound, 12 | N-phenyl-5-[(thiophe...)
Show SMILES C(Sc1nnc(Nc2ccccc2)[nH]1)c1cccs1
Show InChI InChI=1S/C13H12N4S2/c1-2-5-10(6-3-1)14-12-15-13(17-16-12)19-9-11-7-4-8-18-11/h1-8H,9H2,(H2,14,15,16,17)
Affinity DataKi:  0.75nM ΔG°:  -51.6kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17418(1,2,4-Triazole Compound, 76 | methyl 4-[(5-{[(5-me...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCc3cc(C)on3)[nH]2)cc1
Show InChI InChI=1S/C15H15N5O3S/c1-9-7-12(20-23-9)8-24-15-17-14(18-19-15)16-11-5-3-10(4-6-11)13(21)22-2/h3-7H,8H2,1-2H3,(H2,16,17,18,19)
Affinity DataKi:  0.800nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17414(1,2,4-Triazole Compound, 72 | methyl 4-({5-[(pyrid...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCc3ccncc3)[nH]2)cc1
Show InChI InChI=1S/C16H15N5O2S/c1-23-14(22)12-2-4-13(5-3-12)18-15-19-16(21-20-15)24-10-11-6-8-17-9-7-11/h2-9H,10H2,1H3,(H2,18,19,20,21)
Affinity DataKi:  0.900nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17405(1,2,4-Triazole Compound, 63 | N-(3,4-dimethoxyphen...)
Show SMILES COc1ccc(Nc2nnc(SCC=C(C)C)[nH]2)cc1OC
Show InChI InChI=1S/C15H20N4O2S/c1-10(2)7-8-22-15-17-14(18-19-15)16-11-5-6-12(20-3)13(9-11)21-4/h5-7,9H,8H2,1-4H3,(H2,16,17,18,19)
Affinity DataKi:  0.900nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17413(1,2,4-Triazole Compound, 71 | methyl 4-({5-[(pyrid...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCc3ccccn3)[nH]2)cc1
Show InChI InChI=1S/C16H15N5O2S/c1-23-14(22)11-5-7-12(8-6-11)18-15-19-16(21-20-15)24-10-13-4-2-3-9-17-13/h2-9H,10H2,1H3,(H2,18,19,20,21)
Affinity DataKi:  0.900nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17442(1,2,4-Triazole Compound, 101 | 5-[(3-methylbut-2-e...)
Show SMILES CC(C)=CCSc1nnc(Nc2ccccc2)[nH]1
Show InChI InChI=1S/C13H16N4S/c1-10(2)8-9-18-13-15-12(16-17-13)14-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3,(H2,14,15,16,17)
Affinity DataKi:  1nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17446((3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-m...)
Show SMILES CO[C@@H]1[C@@H](CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C)OC(=O)NC(=O)CCl
Show InChI InChI=1S/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15-,16-,18+,19+/m1/s1
Affinity DataKi:  1nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17373(1,2,4-Triazole Compound, 31 | 5-[(3-methylbut-2-en...)
Show SMILES CC(C)=CCSc1nnc(Nc2ccc(C)cc2)[nH]1
Show InChI InChI=1S/C14H18N4S/c1-10(2)8-9-19-14-16-13(17-18-14)15-12-6-4-11(3)5-7-12/h4-8H,9H2,1-3H3,(H2,15,16,17,18)
Affinity DataKi:  1.20nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17400(1,2,4-Triazole Compound, 58 | N-(3,4-dimethoxyphen...)
Show SMILES COc1ccc(Nc2nnc(SCc3ccccc3F)[nH]2)cc1OC
Show InChI InChI=1S/C17H17FN4O2S/c1-23-14-8-7-12(9-15(14)24-2)19-16-20-17(22-21-16)25-10-11-5-3-4-6-13(11)18/h3-9H,10H2,1-2H3,(H2,19,20,21,22)
Affinity DataKi:  1.30nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17412(1,2,4-Triazole Compound, 70 | methyl 4-[(5-{[(3,4-...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCc3ccc(F)c(F)c3)[nH]2)cc1
Show InChI InChI=1S/C17H14F2N4O2S/c1-25-15(24)11-3-5-12(6-4-11)20-16-21-17(23-22-16)26-9-10-2-7-13(18)14(19)8-10/h2-8H,9H2,1H3,(H2,20,21,22,23)
Affinity DataKi:  1.30nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17381(1,2,4-Triazole Compound, 39 | N-(4-chlorophenyl)-5...)
Show SMILES Fc1ccc(CSc2nnc(Nc3ccc(Cl)cc3)[nH]2)cc1F
Show InChI InChI=1S/C15H11ClF2N4S/c16-10-2-4-11(5-3-10)19-14-20-15(22-21-14)23-8-9-1-6-12(17)13(18)7-9/h1-7H,8H2,(H2,19,20,21,22)
Affinity DataKi:  1.5nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17436(1,2,4-Triazole Compound, 94 | N-(5-{[(5-methyl-1,2...)
Show SMILES Cc1cc(CSc2nnc(Nc3cccnc3)[nH]2)no1
Show InChI InChI=1S/C12H12N6OS/c1-8-5-10(18-19-8)7-20-12-15-11(16-17-12)14-9-3-2-4-13-6-9/h2-6H,7H2,1H3,(H2,14,15,16,17)
Affinity DataKi:  1.5nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17396(1,2,4-Triazole Compound, 54 | N-(4-methoxyphenyl)-...)
Show SMILES COc1ccc(Nc2nnc(SCc3cc(C)on3)[nH]2)cc1
Show InChI InChI=1S/C14H15N5O2S/c1-9-7-11(19-21-9)8-22-14-16-13(17-18-14)15-10-3-5-12(20-2)6-4-10/h3-7H,8H2,1-2H3,(H2,15,16,17,18)
Affinity DataKi:  1.60nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17397(1,2,4-Triazole Compound, 55 | 5-(benzylsulfanyl)-N...)
Show SMILES COc1ccc(Nc2nnc(SCc3ccccc3)[nH]2)cc1OC
Show InChI InChI=1S/C17H18N4O2S/c1-22-14-9-8-13(10-15(14)23-2)18-16-19-17(21-20-16)24-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H2,18,19,20,21)
Affinity DataKi:  1.70nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17429(1,2,4-Triazole Compound, 87 | N-(5-{[(2-methylphen...)
Show SMILES Cc1ccccc1CSc1nnc(Nc2cccnc2)[nH]1
Show InChI InChI=1S/C15H15N5S/c1-11-5-2-3-6-12(11)10-21-15-18-14(19-20-15)17-13-7-4-8-16-9-13/h2-9H,10H2,1H3,(H2,17,18,19,20)
Affinity DataKi:  1.70nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17387(1,2,4-Triazole Compound, 45 | N-(4-chlorophenyl)-5...)
Show SMILES Cc1cc(CSc2nnc(Nc3ccc(Cl)cc3)[nH]2)no1
Show InChI InChI=1S/C13H12ClN5OS/c1-8-6-11(19-20-8)7-21-13-16-12(17-18-13)15-10-4-2-9(14)3-5-10/h2-6H,7H2,1H3,(H2,15,16,17,18)
Affinity DataKi:  1.80nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17443(1,2,4-Triazole Compound, 102 | N-[2-(propan-2-yl)p...)
Show SMILES CC(C)c1ccccc1Nc1nnc(SCc2cccs2)[nH]1
Show InChI InChI=1S/C16H18N4S2/c1-11(2)13-7-3-4-8-14(13)17-15-18-16(20-19-15)22-10-12-6-5-9-21-12/h3-9,11H,10H2,1-2H3,(H2,17,18,19,20)
Affinity DataKi:  2nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17391(1,2,4-Triazole Compound, 49 | 5-{[(3,4-difluorophe...)
Show SMILES COc1ccc(Nc2nnc(SCc3ccc(F)c(F)c3)[nH]2)cc1
Show InChI InChI=1S/C16H14F2N4OS/c1-23-12-5-3-11(4-6-12)19-15-20-16(22-21-15)24-9-10-2-7-13(17)14(18)8-10/h2-8H,9H2,1H3,(H2,19,20,21,22)
Affinity DataKi:  2.10nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17359(1,2,4-Triazole Compound, 17 | 5-{[(3,4-difluorophe...)
Show SMILES Cc1ccccc1Nc1nnc(SCc2ccc(F)c(F)c2)[nH]1
Show InChI InChI=1S/C16H14F2N4S/c1-10-4-2-3-5-14(10)19-15-20-16(22-21-15)23-9-11-6-7-12(17)13(18)8-11/h2-8H,9H2,1H3,(H2,19,20,21,22)
Affinity DataKi:  2.40nM ΔG°:  -48.7kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17356(1,2,4-Triazole Compound, 14 | N-(2-methylphenyl)-5...)
Show SMILES Cc1ccccc1CSc1nnc(Nc2ccccc2C)[nH]1
Show InChI InChI=1S/C17H18N4S/c1-12-7-3-5-9-14(12)11-22-17-19-16(20-21-17)18-15-10-6-4-8-13(15)2/h3-10H,11H2,1-2H3,(H2,18,19,20,21)
Affinity DataKi:  2.5nM ΔG°:  -48.6kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17383(1,2,4-Triazole Compound, 41 | N-(4-chlorophenyl)-5...)
Show SMILES Clc1ccc(Nc2nnc(SCc3ccncc3)[nH]2)cc1
Show InChI InChI=1S/C14H12ClN5S/c15-11-1-3-12(4-2-11)17-13-18-14(20-19-13)21-9-10-5-7-16-8-6-10/h1-8H,9H2,(H2,17,18,19,20)
Affinity DataKi:  2.5nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17415(1,2,4-Triazole Compound, 73 | methyl 4-({5-[(cyclo...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCC3CCCCC3)[nH]2)cc1
Show InChI InChI=1S/C17H22N4O2S/c1-23-15(22)13-7-9-14(10-8-13)18-16-19-17(21-20-16)24-11-12-5-3-2-4-6-12/h7-10,12H,2-6,11H2,1H3,(H2,18,19,20,21)
Affinity DataKi:  2.70nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17433(1,2,4-Triazole Compound, 91 | N-{5-[(pyridin-4-ylm...)
Show SMILES C(Sc1nnc(Nc2cccnc2)[nH]1)c1ccncc1
Show InChI InChI=1S/C13H12N6S/c1-2-11(8-15-5-1)16-12-17-13(19-18-12)20-9-10-3-6-14-7-4-10/h1-8H,9H2,(H2,16,17,18,19)
Affinity DataKi:  3nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17444(1,2,4-Triazole Compound, 103 | 5-[(furan-2-ylmethy...)
Show SMILES CC(C)c1ccccc1Nc1nnc(SCc2ccco2)[nH]1
Show InChI InChI=1S/C16H18N4OS/c1-11(2)13-7-3-4-8-14(13)17-15-18-16(20-19-15)22-10-12-6-5-9-21-12/h3-9,11H,10H2,1-2H3,(H2,17,18,19,20)
Affinity DataKi:  3nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17394(1,2,4-Triazole Compound, 52 | 5-[(cyclohexylmethyl...)
Show SMILES COc1ccc(Nc2nnc(SCC3CCCCC3)[nH]2)cc1
Show InChI InChI=1S/C16H22N4OS/c1-21-14-9-7-13(8-10-14)17-15-18-16(20-19-15)22-11-12-5-3-2-4-6-12/h7-10,12H,2-6,11H2,1H3,(H2,17,18,19,20)
Affinity DataKi:  3.10nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17361(1,2,4-Triazole Compound, 19 | 5-[(cyclohexylmethyl...)
Show SMILES Cc1ccccc1Nc1nnc(SCC2CCCCC2)[nH]1
Show InChI InChI=1S/C16H22N4S/c1-12-7-5-6-10-14(12)17-15-18-16(20-19-15)21-11-13-8-3-2-4-9-13/h5-7,10,13H,2-4,8-9,11H2,1H3,(H2,17,18,19,20)
Affinity DataKi:  3.30nM ΔG°:  -47.9kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17369(1,2,4-Triazole Compound, 27 | 5-{[(3,4-difluorophe...)
Show SMILES Cc1ccc(Nc2nnc(SCc3ccc(F)c(F)c3)[nH]2)cc1
Show InChI InChI=1S/C16H14F2N4S/c1-10-2-5-12(6-3-10)19-15-20-16(22-21-15)23-9-11-4-7-13(17)14(18)8-11/h2-8H,9H2,1H3,(H2,19,20,21,22)
Affinity DataKi:  3.30nM ΔG°:  -47.9kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17375(1,2,4-Triazole Compound, 33 | 5-{[(5-methyl-1,2-ox...)
Show SMILES Cc1cc(CSc2nnc(Nc3ccc(C)cc3)[nH]2)no1
Show InChI InChI=1S/C14H15N5OS/c1-9-3-5-11(6-4-9)15-13-16-14(18-17-13)21-8-12-7-10(2)20-19-12/h3-7H,8H2,1-2H3,(H2,15,16,17,18)
Affinity DataKi:  3.5nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17364(1,2,4-Triazole Compound, 22 | 5-{[(5-methyl-1,2-ox...)
Show SMILES Cc1cc(CSc2nnc(Nc3ccccc3C)[nH]2)no1
Show InChI InChI=1S/C14H15N5OS/c1-9-5-3-4-6-12(9)15-13-16-14(18-17-13)21-8-11-7-10(2)20-19-11/h3-7H,8H2,1-2H3,(H2,15,16,17,18)
Affinity DataKi:  3.60nM ΔG°:  -47.7kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17360(1,2,4-Triazole Compound, 18 | N-(2-methylphenyl)-5...)
Show SMILES Cc1ccccc1Nc1nnc(SCc2ccncc2)[nH]1
Show InChI InChI=1S/C15H15N5S/c1-11-4-2-3-5-13(11)17-14-18-15(20-19-14)21-10-12-6-8-16-9-7-12/h2-9H,10H2,1H3,(H2,17,18,19,20)
Affinity DataKi:  3.70nM ΔG°:  -47.6kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17363(1,2,4-Triazole Compound, 21 | 5-{[(2-methyl-1,3-th...)
Show SMILES Cc1nc(CSc2nnc(Nc3ccccc3C)[nH]2)cs1
Show InChI InChI=1S/C14H15N5S2/c1-9-5-3-4-6-12(9)16-13-17-14(19-18-13)21-8-11-7-20-10(2)15-11/h3-7H,8H2,1-2H3,(H2,16,17,18,19)
Affinity DataKi:  3.80nM ΔG°:  -47.6kJ/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17417(1,2,4-Triazole Compound, 75 | methyl 4-[(5-{[(2-me...)
Show SMILES COC(=O)c1ccc(Nc2nnc(SCc3csc(C)n3)[nH]2)cc1
Show InChI InChI=1S/C15H15N5O2S2/c1-9-16-12(7-23-9)8-24-15-18-14(19-20-15)17-11-5-3-10(4-6-11)13(21)22-2/h3-7H,8H2,1-2H3,(H2,17,18,19,20)
Affinity DataKi:  3.80nMAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
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