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Compile Data Set for Download or QSAR

Found 50 hits Enz. Inhib. hit(s) with Target = 'N6-adenosine-methyltransferase catalytic subunit'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586498
PNG
(CHEMBL5077332)
Show SMILES CNc1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2)c1cc(F)c(CN2CCC(C)(C)CC2)cc1F
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n/an/a 5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572906
PNG
(CHEMBL4854665)
Show SMILES CNc1ccc2ccc(OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cc(-c4ccn(C)n4)c4c(N)ncnc34)cc2n1 |r|
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TBA

Assay Description
Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572907
PNG
(CHEMBL4850503)
Show SMILES CCNc1ccc2ccc(OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cc(C4CCCC4)c4c(N)ncnc34)cc2n1 |r|
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TBA

Assay Description
Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572908
PNG
(CHEMBL4872977)
Show SMILES CNc1ccc2ccc(OC[C@H]3O[C@H]([C@@H](F)[C@@H]3O)n3cc(-c4ccc(C)o4)c4c(N)ncnc34)cc2n1 |r|
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TBA

Assay Description
Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572909
PNG
(CHEMBL4856985)
Show SMILES Cc1coc(n1)-c1cn([C@@H]2O[C@H](COc3ccc4ccc(nc4c3)N3CCC3)[C@@H](O)[C@@H]2F)c2ncnc(N)c12 |r|
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TBA

Assay Description
Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572910
PNG
(CHEMBL4861007)
Show SMILES Nc1ncnc2n(cc(-n3cccn3)c12)[C@@H]1O[C@H](COc2ccc3ccc(nc3c2)N2CCC2)[C@@H](O)[C@@H]1F |r|
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TBA

Assay Description
Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572911
PNG
(CHEMBL4852677)
Show SMILES Nc1ncnc2n(cc([C@@H]3CCCO3)c12)[C@@H]1O[C@H](COc2ccc3ccc(nc3c2)N2CCC2)[C@@H](O)[C@@H]1F |r|
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TBA

Assay Description
Inhibition of METTL3 (unknown origin) using 3' biotinylated RNA (UCUGGACUAAA) and 3H-SAM as a substrate preincubated for 5 mins followed by substrate...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611058
PNG
(CHEMBL5279050)
Show SMILES CC1(C)CCN(Cc2ccc(C(=O)NC[C@]3(O)CCCN(C3)c3cc(NCc4ccccc4)ncn3)c(O)c2)CC1 |r|
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n/an/a 17n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611061
PNG
(CHEMBL5291234)
Show SMILES O=C(NCc1cn2cc(CNCC3CCCCC3)ccc2n1)c1cc(=O)n2ccccc2n1
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TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586497
PNG
(CHEMBL5076974)
Show SMILES CC1(C)CCN(Cc2ccc(cc2)N2CC(=O)NC3(CCN(CC3)c3nc(Cl)nc4[nH]ccc34)C2)CC1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586487
PNG
(CHEMBL5087497)
Show SMILES CC1(C)CCN(Cc2ccc(cc2)N2CC(=O)NC3(CCN(CC3)c3cc(NCc4ccccc4)ncn3)C2)CC1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586500
PNG
(CHEMBL5078591)
Show SMILES CNc1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2)c1ccc(CN2CCC(C)(C)CC2)c(F)c1
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n/an/a 32n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586486
PNG
(CHEMBL5082067)
Show SMILES CC1(C)CCN(Cc2ccc(cn2)N2CC(=O)NC3(CCN(CC3)c3cc(NCc4ccccc4)ncn3)C2)CC1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586499
PNG
(CHEMBL5092743)
Show SMILES CNc1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2)c1ccc(CN2CCC(C)(C)CC2)cc1F
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n/an/a 38n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586495
PNG
(CHEMBL5084119)
Show SMILES CC1(C)CCN(Cc2ccc(cc2)N2CC(=O)NC3(CCN(CC3)c3ncnc4[nH]ccc34)C2)CC1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586494
PNG
(CHEMBL5092187)
Show SMILES CC1(C)CCN(Cc2ccc(cc2)N2CC(=O)NC3(CCN(CC3)c3cc(NC4CC4)ncn3)C2)CC1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586488
PNG
(CHEMBL5084812)
Show SMILES CNc1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2)c1ccc(CN2CCC(C)(C)CC2)cc1
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n/an/a 89n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586485
PNG
(CHEMBL5077723)
Show SMILES CC1(C)CCN(Cc2ccc(cn2)N2CCOC3(CCN(CC3)c3cc(NCc4ccccc4)ncn3)C2)CC1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611058
PNG
(CHEMBL5279050)
Show SMILES CC1(C)CCN(Cc2ccc(C(=O)NC[C@]3(O)CCCN(C3)c3cc(NCc4ccccc4)ncn3)c(O)c2)CC1 |r|
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TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586493
PNG
(CHEMBL5083998)
Show SMILES CC(C)Nc1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2)c1ccc(CN2CCC(C)(C)CC2)cc1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586489
PNG
(CHEMBL5094039)
Show SMILES CNc1cc(ncn1)N1CC2(C1)CN(CC(=O)N2)c1ccc(CN2CCC(C)(C)CC2)cc1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50009672
PNG
(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
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n/an/a 590n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586483
PNG
(CHEMBL5091512)
Show SMILES CC1(C)CCN(Cc2ccc(NCC3(O)CCN(CC3)c3cc(NCc4ccccc4)ncn3)cn2)CC1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586492
PNG
(CHEMBL5076504)
Show SMILES CN(C)c1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2)c1ccc(CN2CCC(C)(C)CC2)cc1
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TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572911
PNG
(CHEMBL4852677)
Show SMILES Nc1ncnc2n(cc([C@@H]3CCCO3)c12)[C@@H]1O[C@H](COc2ccc3ccc(nc3c2)N2CCC2)[C@@H](O)[C@@H]1F |r|
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n/an/a<1.00E+3n/an/an/an/an/an/a


TBA

Assay 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 analysis


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572907
PNG
(CHEMBL4850503)
Show SMILES CCNc1ccc2ccc(OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cc(C4CCCC4)c4c(N)ncnc34)cc2n1 |r|
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TBA

Assay 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 analysis


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572909
PNG
(CHEMBL4856985)
Show SMILES Cc1coc(n1)-c1cn([C@@H]2O[C@H](COc3ccc4ccc(nc4c3)N3CCC3)[C@@H](O)[C@@H]2F)c2ncnc(N)c12 |r|
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n/an/a<1.00E+3n/an/an/an/an/an/a


TBA

Assay 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 analysis


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572910
PNG
(CHEMBL4861007)
Show SMILES Nc1ncnc2n(cc(-n3cccn3)c12)[C@@H]1O[C@H](COc2ccc3ccc(nc3c2)N2CCC2)[C@@H](O)[C@@H]1F |r|
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n/an/a<1.00E+3n/an/an/an/an/an/a


TBA

Assay 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 analysis


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572908
PNG
(CHEMBL4872977)
Show SMILES CNc1ccc2ccc(OC[C@H]3O[C@H]([C@@H](F)[C@@H]3O)n3cc(-c4ccc(C)o4)c4c(N)ncnc34)cc2n1 |r|
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n/an/a<1.00E+3n/an/an/an/an/an/a


TBA

Assay 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 analysis


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50572906
PNG
(CHEMBL4854665)
Show SMILES CNc1ccc2ccc(OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cc(-c4ccn(C)n4)c4c(N)ncnc34)cc2n1 |r|
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n/an/a<1.00E+3n/an/an/an/an/an/a


TBA

Assay 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 analysis


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00280
BindingDB Entry DOI: 10.7270/Q2GQ72JV
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586491
PNG
(CHEMBL5081806)
Show SMILES CNc1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2C)c1ccc(CN2CCC(C)(C)CC2)cc1
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n/an/a 1.50E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586490
PNG
(CHEMBL5083959)
Show SMILES CNc1cc(ncn1)N1CCC2(CN(C(=O)N2)c2ccc(CN3CCC(C)(C)CC3)cc2)CC1
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n/an/a 1.80E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586484
PNG
(CHEMBL5092569)
Show SMILES CC1(C)CCN(Cc2ccc(cn2)C(=O)NC2CCN(CC2)c2cc(NCc3ccccc3)ncn2)CC1
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n/an/a 3.60E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586496
PNG
(CHEMBL5072742)
Show SMILES CC1(C)CCN(Cc2ccc(cc2)N2CC(=O)NC3(CCN(CC3)c3ccnc4[nH]ccc34)C2)CC1
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n/an/a 4.50E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586481
PNG
(CHEMBL5091996)
Show SMILES CNc1cc(ncn1)N1CCC(O)(CNc2ccc(CN3CCC(C)(C)CC3)cn2)CC1
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n/an/a 4.60E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586480
PNG
(CHEMBL5094929)
Show SMILES CNc1cc(ncn1)N1CCC(O)(CNc2ccc(CN3CCC(C)(C)CC3)cc2)CC1
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n/an/a 5.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586482
PNG
(CHEMBL5078612)
Show SMILES CNc1cc(ncn1)N1CCC(O)(CNc2ccc(CN3CCC(C)(C)CC3)nc2)CC1
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n/an/a 5.80E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586479
PNG
(CHEMBL5081407)
Show SMILES CNc1cc(ncn1)N1CCCC(O)(CNC(=O)c2ccc(CN3CCC(C)(C)CC3)cc2)C1
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n/an/a 7.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant METLL3 (unknown origin) expressed in baculovirus infected Sf9 cells assessed as decrease in N6-methyladenosine level in oli...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611052
PNG
(CHEMBL5270921)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NCCCCN1CCCC1 |r|
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n/an/a 8.70E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611059
PNG
(CHEMBL5286034)
Show SMILES CC1(C)CCN(Cc2ccc(C(=O)NC[C@@]3(O)CCCN(C3)c3cc(NCc4ccccc4)ncn3)c(O)c2)CC1 |r|
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n/an/a 2.80E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611060
PNG
(CHEMBL5288865)
Show SMILES O=C(NCc1ccc(cc1)N1CCCC1=O)c1cc(=O)c2ccccc2o1
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n/an/a 5.17E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611055
PNG
(CHEMBL5282296)
Show SMILES CN1CCC(CC1)NC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
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n/an/a 6.50E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611056
PNG
(CHEMBL5276433)
Show SMILES CNC1CCC(O)(Cn2cnc3c(N)ncnc23)C(O)C1
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n/an/a 9.80E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611054
PNG
(CHEMBL5281978)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NCC1CCNCC1 |r|
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n/an/a>2.50E+5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611057
PNG
(CHEMBL5286336)
Show SMILES N[C@@H]1CO[C@H](Cn2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O |r|
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n/an/a>2.50E+5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611053
PNG
(CHEMBL5281651)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NCCCNC(=O)c1ccccn1 |r|
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n/an/a 3.32E+5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM14487
PNG
((2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxy...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
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n/an/a 4.95E+5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586498
PNG
(CHEMBL5077332)
Show SMILES CNc1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2)c1cc(F)c(CN2CCC(C)(C)CC2)cc1F
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n/an/an/an/a 2.00E+3n/an/an/an/a


TBA

Assay Description
Thermal stabilization of recombinant METTL3 (354 to 580 residues) (unknown origin) expressed in HEK293T cells assessed as non-aggregated METTL3-ePL p...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50611061
PNG
(CHEMBL5291234)
Show SMILES O=C(NCc1cn2cc(CNCC3CCCCC3)ccc2n1)c1cc(=O)n2ccccc2n1
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n/an/an/a 1.40n/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N6-adenosine-methyltransferase catalytic subunit


(Homo sapiens)
BDBM50586498
PNG
(CHEMBL5077332)
Show SMILES CNc1cc(ncn1)N1CCC2(CC1)CN(CC(=O)N2)c1cc(F)c(CN2CCC(C)(C)CC2)cc1F
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n/an/an/an/a 850n/an/an/an/a


TBA

Assay Description
Thermal stabilization of endogenously expressing full length METTL3 in human MOLM-13 cells assessed as stabilized METTL3 incubated for at 54 degC by ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00773
BindingDB Entry DOI: 10.7270/Q2PK0M21
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)