Compile Data Set for Download or QSAR
Found 12 of affinity data for UniProtKB/TrEMBL: Q86U44
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572906(CHEMBL4854665)
Show SMILES CNc1ccc2ccc(OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cc(-c4ccn(C)n4)c4c(N)ncnc34)cc2n1
Show InChI InChI=1S/C25H26N8O4/c1-27-19-6-4-13-3-5-14(9-17(13)30-19)36-11-18-21(34)22(35)25(37-18)33-10-15(16-7-8-32(2)31-16)20-23(26)28-12-29-24(20)33/h3-10,12,18,21-22,25,34-35H,11H2,1-2H3,(H,27,30)(H2,26,28,29)/t18-,21-,22-,25-/m1/s1
Affinity DataIC50: 10nMAssay Description:Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572907(CHEMBL4850503)
Show SMILES CCNc1ccc2ccc(OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cc(C4CCCC4)c4c(N)ncnc34)cc2n1
Show InChI InChI=1S/C27H32N6O4/c1-2-29-21-10-8-16-7-9-17(11-19(16)32-21)36-13-20-23(34)24(35)27(37-20)33-12-18(15-5-3-4-6-15)22-25(28)30-14-31-26(22)33/h7-12,14-15,20,23-24,27,34-35H,2-6,13H2,1H3,(H,29,32)(H2,28,30,31)/t20-,23-,24-,27-/m1/s1
Affinity DataIC50: 10nMAssay Description:Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572908(CHEMBL4872977)
Show SMILES CNc1ccc2ccc(OC[C@H]3O[C@H]([C@@H](F)[C@@H]3O)n3cc(-c4ccc(C)o4)c4c(N)ncnc34)cc2n1
Show InChI InChI=1S/C26H25FN6O4/c1-13-3-7-18(36-13)16-10-33(25-21(16)24(28)30-12-31-25)26-22(27)23(34)19(37-26)11-35-15-6-4-14-5-8-20(29-2)32-17(14)9-15/h3-10,12,19,22-23,26,34H,11H2,1-2H3,(H,29,32)(H2,28,30,31)/t19-,22+,23-,26-/m1/s1
Affinity DataIC50: 10nMAssay Description:Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572909(CHEMBL4856985)
Show SMILES Cc1coc(n1)-c1cn([C@@H]2O[C@H](COc3ccc4ccc(nc4c3)N3CCC3)[C@@H](O)[C@@H]2F)c2ncnc(N)c12
Show InChI InChI=1S/C27H26FN7O4/c1-14-11-38-26(32-14)17-10-35(25-21(17)24(29)30-13-31-25)27-22(28)23(36)19(39-27)12-37-16-5-3-15-4-6-20(33-18(15)9-16)34-7-2-8-34/h3-6,9-11,13,19,22-23,27,36H,2,7-8,12H2,1H3,(H2,29,30,31)/t19-,22+,23-,27-/m1/s1
Affinity DataIC50: 10nMAssay Description:Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572910(CHEMBL4861007)
Show SMILES Nc1ncnc2n(cc(-n3cccn3)c12)[C@@H]1O[C@H](COc2ccc3ccc(nc3c2)N2CCC2)[C@@H](O)[C@@H]1F
Show InChI InChI=1S/C26H25FN8O3/c27-22-23(36)19(13-37-16-5-3-15-4-6-20(32-17(15)11-16)33-8-2-9-33)38-26(22)34-12-18(35-10-1-7-31-35)21-24(28)29-14-30-25(21)34/h1,3-7,10-12,14,19,22-23,26,36H,2,8-9,13H2,(H2,28,29,30)/t19-,22+,23-,26-/m1/s1
Affinity DataIC50: 10nMAssay Description:Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572911(CHEMBL4852677)
Show SMILES Nc1ncnc2n(cc([C@@H]3CCCO3)c12)[C@@H]1O[C@H](COc2ccc3ccc(nc3c2)N2CCC2)[C@@H](O)[C@@H]1F
Show InChI InChI=1S/C27H29FN6O4/c28-23-24(35)20(13-37-16-6-4-15-5-7-21(32-18(15)11-16)33-8-2-9-33)38-27(23)34-12-17(19-3-1-10-36-19)22-25(29)30-14-31-26(22)34/h4-7,11-12,14,19-20,23-24,27,35H,1-3,8-10,13H2,(H2,29,30,31)/t19-,20+,23-,24+,27+/m0/s1
Affinity DataIC50: 10nMAssay Description:Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572906(CHEMBL4854665)
Show SMILES CNc1ccc2ccc(OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cc(-c4ccn(C)n4)c4c(N)ncnc34)cc2n1
Show InChI InChI=1S/C25H26N8O4/c1-27-19-6-4-13-3-5-14(9-17(13)30-19)36-11-18-21(34)22(35)25(37-18)33-10-15(16-7-8-32(2)31-16)20-23(26)28-12-29-24(20)33/h3-10,12,18,21-22,25,34-35H,11H2,1-2H3,(H,27,30)(H2,26,28,29)/t18-,21-,22-,25-/m1/s1
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of METTL3-mediated m6A methylation in human MOLM-3 cells assessed as reduction in mRNA level measured after 24 hrs by LC-MS/MS analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572907(CHEMBL4850503)
Show SMILES CCNc1ccc2ccc(OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cc(C4CCCC4)c4c(N)ncnc34)cc2n1
Show InChI InChI=1S/C27H32N6O4/c1-2-29-21-10-8-16-7-9-17(11-19(16)32-21)36-13-20-23(34)24(35)27(37-20)33-12-18(15-5-3-4-6-15)22-25(28)30-14-31-26(22)33/h7-12,14-15,20,23-24,27,34-35H,2-6,13H2,1H3,(H,29,32)(H2,28,30,31)/t20-,23-,24-,27-/m1/s1
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of METTL3-mediated m6A methylation in human MOLM-3 cells assessed as reduction in mRNA level measured after 24 hrs by LC-MS/MS analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572908(CHEMBL4872977)
Show SMILES CNc1ccc2ccc(OC[C@H]3O[C@H]([C@@H](F)[C@@H]3O)n3cc(-c4ccc(C)o4)c4c(N)ncnc34)cc2n1
Show InChI InChI=1S/C26H25FN6O4/c1-13-3-7-18(36-13)16-10-33(25-21(16)24(28)30-12-31-25)26-22(27)23(34)19(37-26)11-35-15-6-4-14-5-8-20(29-2)32-17(14)9-15/h3-10,12,19,22-23,26,34H,11H2,1-2H3,(H,29,32)(H2,28,30,31)/t19-,22+,23-,26-/m1/s1
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of METTL3-mediated m6A methylation in human MOLM-3 cells assessed as reduction in mRNA level measured after 24 hrs by LC-MS/MS analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572909(CHEMBL4856985)
Show SMILES Cc1coc(n1)-c1cn([C@@H]2O[C@H](COc3ccc4ccc(nc4c3)N3CCC3)[C@@H](O)[C@@H]2F)c2ncnc(N)c12
Show InChI InChI=1S/C27H26FN7O4/c1-14-11-38-26(32-14)17-10-35(25-21(17)24(29)30-13-31-25)27-22(28)23(36)19(39-27)12-37-16-5-3-15-4-6-20(33-18(15)9-16)34-7-2-8-34/h3-6,9-11,13,19,22-23,27,36H,2,7-8,12H2,1H3,(H2,29,30,31)/t19-,22+,23-,27-/m1/s1
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of METTL3-mediated m6A methylation in human MOLM-3 cells assessed as reduction in mRNA level measured after 24 hrs by LC-MS/MS analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572910(CHEMBL4861007)
Show SMILES Nc1ncnc2n(cc(-n3cccn3)c12)[C@@H]1O[C@H](COc2ccc3ccc(nc3c2)N2CCC2)[C@@H](O)[C@@H]1F
Show InChI InChI=1S/C26H25FN8O3/c27-22-23(36)19(13-37-16-5-3-15-4-6-20(32-17(15)11-16)33-8-2-9-33)38-26(22)34-12-18(35-10-1-7-31-35)21-24(28)29-14-30-25(21)34/h1,3-7,10-12,14,19,22-23,26,36H,2,8-9,13H2,(H2,28,29,30)/t19-,22+,23-,26-/m1/s1
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of METTL3-mediated m6A methylation in human MOLM-3 cells assessed as reduction in mRNA level measured after 24 hrs by LC-MS/MS analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetN6-adenosine-methyltransferase catalytic subunit(Homo sapiens)
Smith, Gambrell & Russell LLP

Curated by ChEMBL
LigandPNGBDBM50572911(CHEMBL4852677)
Show SMILES Nc1ncnc2n(cc([C@@H]3CCCO3)c12)[C@@H]1O[C@H](COc2ccc3ccc(nc3c2)N2CCC2)[C@@H](O)[C@@H]1F
Show InChI InChI=1S/C27H29FN6O4/c28-23-24(35)20(13-37-16-6-4-15-5-7-21(32-18(15)11-16)33-8-2-9-33)38-27(23)34-12-17(19-3-1-10-36-19)22-25(29)30-14-31-26(22)34/h4-7,11-12,14,19-20,23-24,27,35H,1-3,8-10,13H2,(H2,29,30,31)/t19-,20+,23-,24+,27+/m0/s1
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of METTL3-mediated m6A methylation in human MOLM-3 cells assessed as reduction in mRNA level measured after 24 hrs by LC-MS/MS analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid