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Compile Data Set for Download or QSAR

Found 264 hits with Last Name = 'eam' and Initial = 'b'   
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
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM50263270
PNG
(CHEMBL4086747)
Show SMILES Nc1ncnc(Nc2cc(Cl)c3C(=O)NC4(CCCCC4)n3c2=O)c1Cl
Show InChI InChI=1S/C16H16Cl2N6O2/c17-8-6-9(22-13-10(18)12(19)20-7-21-13)15(26)24-11(8)14(25)23-16(24)4-2-1-3-5-16/h6-7H,1-5H2,(H,23,25)(H3,19,20,21,22)
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n/an/a 0.0840n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50263254
PNG
(CHEMBL4094975)
Show SMILES Nc1cc(Nc2cc(Cl)c3C(=O)NC4(CCCC4)n3c2=O)ncn1
Show InChI InChI=1S/C15H15ClN6O2/c16-8-5-9(20-11-6-10(17)18-7-19-11)14(24)22-12(8)13(23)21-15(22)3-1-2-4-15/h5-7H,1-4H2,(H,21,23)(H3,17,18,19,20)
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n/an/a 0.130n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50263253
PNG
(CHEMBL4067557)
Show SMILES CC1(C)NC(=O)c2c(Cl)cc(Nc3cc(N)ncn3)c(=O)n12
Show InChI InChI=1S/C13H13ClN6O2/c1-13(2)19-11(21)10-6(14)3-7(12(22)20(10)13)18-9-4-8(15)16-5-17-9/h3-5H,1-2H3,(H,19,21)(H3,15,16,17,18)
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n/an/a 0.140n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM168214
PNG
(US9669031, 207 6′-((6-aminopyrimidin-4-yl)am...)
Show SMILES Clc1cc(Nc2cc(NC(=O)C3CC3)ncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C20H21ClN6O3/c21-12-8-13(24-14-9-15(23-10-22-14)25-17(28)11-4-5-11)19(30)27-16(12)18(29)26-20(27)6-2-1-3-7-20/h8-11H,1-7H2,(H,26,29)(H2,22,23,24,25,28)
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n/an/a 0.310n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50263270
PNG
(CHEMBL4086747)
Show SMILES Nc1ncnc(Nc2cc(Cl)c3C(=O)NC4(CCCCC4)n3c2=O)c1Cl
Show InChI InChI=1S/C16H16Cl2N6O2/c17-8-6-9(22-13-10(18)12(19)20-7-21-13)15(26)24-11(8)14(25)23-16(24)4-2-1-3-5-16/h6-7H,1-5H2,(H,23,25)(H3,19,20,21,22)
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n/an/a 0.360n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM168214
PNG
(US9669031, 207 6′-((6-aminopyrimidin-4-yl)am...)
Show SMILES Clc1cc(Nc2cc(NC(=O)C3CC3)ncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C20H21ClN6O3/c21-12-8-13(24-14-9-15(23-10-22-14)25-17(28)11-4-5-11)19(30)27-16(12)18(29)26-20(27)6-2-1-3-7-20/h8-11H,1-7H2,(H,26,29)(H2,22,23,24,25,28)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM50263254
PNG
(CHEMBL4094975)
Show SMILES Nc1cc(Nc2cc(Cl)c3C(=O)NC4(CCCC4)n3c2=O)ncn1
Show InChI InChI=1S/C15H15ClN6O2/c16-8-5-9(20-11-6-10(17)18-7-19-11)14(24)22-12(8)13(23)21-15(22)3-1-2-4-15/h5-7H,1-4H2,(H,21,23)(H3,17,18,19,20)
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n/an/a 0.620n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50263269
PNG
(CHEMBL4076439)
Show SMILES Nc1cc(Nc2cc(Cl)c3C(=O)NC4(CCCCC4)n3c2=O)ncn1
Show InChI InChI=1S/C16H17ClN6O2/c17-9-6-10(21-12-7-11(18)19-8-20-12)15(25)23-13(9)14(24)22-16(23)4-2-1-3-5-16/h6-8H,1-5H2,(H,22,24)(H3,18,19,20,21)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50263269
PNG
(CHEMBL4076439)
Show SMILES Nc1cc(Nc2cc(Cl)c3C(=O)NC4(CCCCC4)n3c2=O)ncn1
Show InChI InChI=1S/C16H17ClN6O2/c17-9-6-10(21-12-7-11(18)19-8-20-12)15(25)23-13(9)14(24)22-16(23)4-2-1-3-5-16/h6-8H,1-5H2,(H,22,24)(H3,18,19,20,21)
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n/an/a 0.680n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM50263269
PNG
(CHEMBL4076439)
Show SMILES Nc1cc(Nc2cc(Cl)c3C(=O)NC4(CCCCC4)n3c2=O)ncn1
Show InChI InChI=1S/C16H17ClN6O2/c17-9-6-10(21-12-7-11(18)19-8-20-12)15(25)23-13(9)14(24)22-16(23)4-2-1-3-5-16/h6-8H,1-5H2,(H,22,24)(H3,18,19,20,21)
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n/an/a 0.790n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50263254
PNG
(CHEMBL4094975)
Show SMILES Nc1cc(Nc2cc(Cl)c3C(=O)NC4(CCCC4)n3c2=O)ncn1
Show InChI InChI=1S/C15H15ClN6O2/c16-8-5-9(20-11-6-10(17)18-7-19-11)14(24)22-12(8)13(23)21-15(22)3-1-2-4-15/h5-7H,1-4H2,(H,21,23)(H3,17,18,19,20)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50263263
PNG
(CHEMBL4073443)
Show SMILES Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C17H20N6O2/c1-10-7-11(21-13-8-12(18)19-9-20-13)16(25)23-14(10)15(24)22-17(23)5-3-2-4-6-17/h7-9H,2-6H2,1H3,(H,22,24)(H3,18,19,20,21)
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n/an/a 1n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50263255
PNG
(CHEMBL4065802)
Show SMILES Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCC(F)(F)CC1
Show InChI InChI=1S/C17H18F2N6O2/c1-9-6-10(23-12-7-11(20)21-8-22-12)15(27)25-13(9)14(26)24-17(25)4-2-16(18,19)3-5-17/h6-8H,2-5H2,1H3,(H,24,26)(H3,20,21,22,23)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM168222
PNG
(US9669031, 51 N-[6-[[8-chloro-3-(3-chlorophenyl)-3...)
Show SMILES CC1(NC(=O)c2c(Cl)cc(Nc3cc(NC(=O)C4CC4)ncn3)c(=O)n12)c1cccc(Cl)c1
Show InChI InChI=1S/C22H18Cl2N6O3/c1-22(12-3-2-4-13(23)7-12)29-20(32)18-14(24)8-15(21(33)30(18)22)27-16-9-17(26-10-25-16)28-19(31)11-5-6-11/h2-4,7-11H,5-6H2,1H3,(H,29,32)(H2,25,26,27,28,31)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM168216
PNG
(US9669031, 181 3,3-dimethyl-1,5-dioxo-6-(pyrimidin...)
Show SMILES CC1(C)NC(=O)c2c(Cl)cc(Nc3ccncn3)c(=O)n12
Show InChI InChI=1S/C13H12ClN5O2/c1-13(2)18-11(20)10-7(14)5-8(12(21)19(10)13)17-9-3-4-15-6-16-9/h3-6H,1-2H3,(H,18,20)(H,15,16,17)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50263255
PNG
(CHEMBL4065802)
Show SMILES Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCC(F)(F)CC1
Show InChI InChI=1S/C17H18F2N6O2/c1-9-6-10(23-12-7-11(20)21-8-22-12)15(27)25-13(9)14(26)24-17(25)4-2-16(18,19)3-5-17/h6-8H,2-5H2,1H3,(H,24,26)(H3,20,21,22,23)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50540861
PNG
(EFT-226 | Eft226 | Zotatifin)
Show SMILES COc1cc2O[C@]3([C@@H]([C@@H](CN(C)C)[C@@H](O)[C@@]3(O)c2c(OC)n1)c1ccccc1)c1ccc(cc1)C#N
Show InChI InChI=1S/C28H29N3O5/c1-31(2)16-20-23(18-8-6-5-7-9-18)28(19-12-10-17(15-29)11-13-19)27(33,25(20)32)24-21(36-28)14-22(34-3)30-26(24)35-4/h5-14,20,23,25,32-33H,16H2,1-4H3/t20-,23-,25-,27+,28+/m1/s1
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n/an/a 1.5n/an/an/an/an/an/a



Inception Therapeutics

Curated by ChEMBL


Assay Description
Inhibition of eIF4A1 in human MDA-MB-231 cells assessed as inhibition of cellular-translation incubated for 4 hrs by specific tandem sequence motif r...


J Med Chem 63: 5879-5955 (2020)


Article DOI: 10.1021/acs.jmedchem.0c00182
BindingDB Entry DOI: 10.7270/Q2MC93K8
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50263264
PNG
(CHEMBL4094080)
Show SMILES N[C@H]1C[C@@H](C1)Oc1ccc2ncc(-c3ccc4cnccc4c3)n2n1 |r,wU:3.5,wD:1.0,(36.72,-33.01,;35.21,-33.32,;33.93,-32.47,;33.08,-33.76,;34.37,-34.61,;31.57,-34.07,;30.55,-32.92,;29.04,-33.23,;28.03,-32.08,;28.51,-30.62,;27.74,-29.3,;28.77,-28.15,;30.18,-28.78,;31.51,-28.01,;31.51,-26.46,;32.84,-25.69,;34.17,-26.46,;35.5,-25.68,;36.83,-26.44,;36.84,-27.99,;35.51,-28.77,;34.17,-28,;32.84,-28.78,;30.01,-30.31,;31.04,-31.45,)|
Show InChI InChI=1S/C19H17N5O/c20-15-8-16(9-15)25-19-4-3-18-22-11-17(24(18)23-19)13-1-2-14-10-21-6-5-12(14)7-13/h1-7,10-11,15-16H,8-9,20H2/t15-,16-
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM168222
PNG
(US9669031, 51 N-[6-[[8-chloro-3-(3-chlorophenyl)-3...)
Show SMILES CC1(NC(=O)c2c(Cl)cc(Nc3cc(NC(=O)C4CC4)ncn3)c(=O)n12)c1cccc(Cl)c1
Show InChI InChI=1S/C22H18Cl2N6O3/c1-22(12-3-2-4-13(23)7-12)29-20(32)18-14(24)8-15(21(33)30(18)22)27-16-9-17(26-10-25-16)28-19(31)11-5-6-11/h2-4,7-11H,5-6H2,1H3,(H,29,32)(H2,25,26,27,28,31)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM168214
PNG
(US9669031, 207 6′-((6-aminopyrimidin-4-yl)am...)
Show SMILES Clc1cc(Nc2cc(NC(=O)C3CC3)ncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C20H21ClN6O3/c21-12-8-13(24-14-9-15(23-10-22-14)25-17(28)11-4-5-11)19(30)27-16(12)18(29)26-20(27)6-2-1-3-7-20/h8-11H,1-7H2,(H,26,29)(H2,22,23,24,25,28)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM168222
PNG
(US9669031, 51 N-[6-[[8-chloro-3-(3-chlorophenyl)-3...)
Show SMILES CC1(NC(=O)c2c(Cl)cc(Nc3cc(NC(=O)C4CC4)ncn3)c(=O)n12)c1cccc(Cl)c1
Show InChI InChI=1S/C22H18Cl2N6O3/c1-22(12-3-2-4-13(23)7-12)29-20(32)18-14(24)8-15(21(33)30(18)22)27-16-9-17(26-10-25-16)28-19(31)11-5-6-11/h2-4,7-11H,5-6H2,1H3,(H,29,32)(H2,25,26,27,28,31)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM297345
PNG
(N-(6-((1-oxoisoindolin-5-yl)amino)pyrimidin-4-yl)c...)
Show SMILES O=C(Nc1cc(Nc2ccc3C(=O)NCc3c2)ncn1)C1CC1
Show InChI InChI=1S/C16H15N5O2/c22-15(9-1-2-9)21-14-6-13(18-8-19-14)20-11-3-4-12-10(5-11)7-17-16(12)23/h3-6,8-9H,1-2,7H2,(H,17,23)(H2,18,19,20,21,22)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50263253
PNG
(CHEMBL4067557)
Show SMILES CC1(C)NC(=O)c2c(Cl)cc(Nc3cc(N)ncn3)c(=O)n12
Show InChI InChI=1S/C13H13ClN6O2/c1-13(2)19-11(21)10-6(14)3-7(12(22)20(10)13)18-9-4-8(15)16-5-17-9/h3-5H,1-2H3,(H,19,21)(H3,15,16,17,18)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50576672
PNG
(CHEMBL4857096)
Show SMILES COc1cncc2O[C@]3([C@@H]([C@@H](CO)[C@H](CNC4COC4)[C@@]3(O)c12)c1ccccc1)c1ccc(Br)cc1 |r|
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TBA

Assay Description
Inhibition of eIF4A (unknown origin) assessed as inhibition of translation of RNA featuring highly structured 5'-UTR of c-Myc


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128111
BindingDB Entry DOI: 10.7270/Q2GQ72K9
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM164271
PNG
(US9669031, 10 N-(6-((3,3-dimethyl-1,5-dioxo-1,2,3,...)
Show SMILES CC1(C)NC(=O)c2ccc(Nc3cc(NC(=O)C4CC4)ncn3)c(=O)n12
Show InChI InChI=1S/C17H18N6O3/c1-17(2)22-15(25)11-6-5-10(16(26)23(11)17)20-12-7-13(19-8-18-12)21-14(24)9-3-4-9/h5-9H,3-4H2,1-2H3,(H,22,25)(H2,18,19,20,21,24)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50263263
PNG
(CHEMBL4073443)
Show SMILES Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C17H20N6O2/c1-10-7-11(21-13-8-12(18)19-9-20-13)16(25)23-14(10)15(24)22-17(23)5-3-2-4-6-17/h7-9H,2-6H2,1H3,(H,22,24)(H3,18,19,20,21)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM168241
PNG
(US9669031, 69 8-fluoro-3,3-dimethyl-6-(pyrimidin-4...)
Show SMILES CC1(C)NC(=O)c2c(F)cc(Nc3ccncn3)c(=O)n12
Show InChI InChI=1S/C13H12FN5O2/c1-13(2)18-11(20)10-7(14)5-8(12(21)19(10)13)17-9-3-4-15-6-16-9/h3-6H,1-2H3,(H,18,20)(H,15,16,17)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM164271
PNG
(US9669031, 10 N-(6-((3,3-dimethyl-1,5-dioxo-1,2,3,...)
Show SMILES CC1(C)NC(=O)c2ccc(Nc3cc(NC(=O)C4CC4)ncn3)c(=O)n12
Show InChI InChI=1S/C17H18N6O3/c1-17(2)22-15(25)11-6-5-10(16(26)23(11)17)20-12-7-13(19-8-18-12)21-14(24)9-3-4-9/h5-9H,3-4H2,1-2H3,(H,22,25)(H2,18,19,20,21,24)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM168216
PNG
(US9669031, 181 3,3-dimethyl-1,5-dioxo-6-(pyrimidin...)
Show SMILES CC1(C)NC(=O)c2c(Cl)cc(Nc3ccncn3)c(=O)n12
Show InChI InChI=1S/C13H12ClN5O2/c1-13(2)18-11(20)10-7(14)5-8(12(21)19(10)13)17-9-3-4-15-6-16-9/h3-6H,1-2H3,(H,18,20)(H,15,16,17)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50196926
PNG
(CHEMBL438139 | Rocaglamide | US10085988, Compound ...)
Show SMILES COc1ccc(cc1)[C@@]12Oc3cc(OC)cc(OC)c3[C@]1(O)[C@H](O)[C@@H]([C@H]2c1ccccc1)C(=O)N(C)C |r|
Show InChI InChI=1S/C29H31NO7/c1-30(2)27(32)23-24(17-9-7-6-8-10-17)29(18-11-13-19(34-3)14-12-18)28(33,26(23)31)25-21(36-5)15-20(35-4)16-22(25)37-29/h6-16,23-24,26,31,33H,1-5H3/t23-,24-,26-,28+,29+/m1/s1
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n/an/a 4.70n/an/an/an/an/an/a



Inception Therapeutics

Curated by ChEMBL


Assay Description
Inhibition of eIF4A1 in human MDA-MB-231 cells assessed as inhibition of cellular-translation incubated for 4 hrs by specific tandem sequence motif r...


J Med Chem 63: 5879-5955 (2020)


Article DOI: 10.1021/acs.jmedchem.0c00182
BindingDB Entry DOI: 10.7270/Q2MC93K8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50576670
PNG
(CHEMBL4864162)
Show SMILES COc1cncc2O[C@]3([C@@H](C[C@H](CN)[C@@]3(O)c12)c1ccccc1)c1ccc(Br)cc1 |r|
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TBA

Assay Description
Inhibition of eIF4A (unknown origin) assessed as inhibition of translation of RNA featuring highly structured 5'-UTR of c-Myc


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128111
BindingDB Entry DOI: 10.7270/Q2GQ72K9
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50576669
PNG
(CHEMBL4855528)
Show SMILES COc1cncc2O[C@]3([C@@H](C[C@H](CN)[C@@]3(O)c12)c1ccccc1)c1ccc(cc1)C#N |r|
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TBA

Assay Description
Inhibition of eIF4A (unknown origin) assessed as inhibition of translation of RNA featuring highly structured 5'-UTR of c-Myc


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128111
BindingDB Entry DOI: 10.7270/Q2GQ72K9
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM297345
PNG
(N-(6-((1-oxoisoindolin-5-yl)amino)pyrimidin-4-yl)c...)
Show SMILES O=C(Nc1cc(Nc2ccc3C(=O)NCc3c2)ncn1)C1CC1
Show InChI InChI=1S/C16H15N5O2/c22-15(9-1-2-9)21-14-6-13(18-8-19-14)20-11-3-4-12-10(5-11)7-17-16(12)23/h3-6,8-9H,1-2,7H2,(H,17,23)(H2,18,19,20,21,22)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM50263263
PNG
(CHEMBL4073443)
Show SMILES Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C17H20N6O2/c1-10-7-11(21-13-8-12(18)19-9-20-13)16(25)23-14(10)15(24)22-17(23)5-3-2-4-6-17/h7-9H,2-6H2,1H3,(H,22,24)(H3,18,19,20,21)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50540861
PNG
(EFT-226 | Eft226 | Zotatifin)
Show SMILES COc1cc2O[C@]3([C@@H]([C@@H](CN(C)C)[C@@H](O)[C@@]3(O)c2c(OC)n1)c1ccccc1)c1ccc(cc1)C#N
Show InChI InChI=1S/C28H29N3O5/c1-31(2)16-20-23(18-8-6-5-7-9-18)28(19-12-10-17(15-29)11-13-19)27(33,25(20)32)24-21(36-28)14-22(34-3)30-26(24)35-4/h5-14,20,23,25,32-33H,16H2,1-4H3/t20-,23-,25-,27+,28+/m1/s1
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n/an/a 6.30n/an/an/an/an/an/a



Inception Therapeutics

Curated by ChEMBL


Assay Description
Inhibition of eIF4A1 in human HAP1 cells assessed as reduction in cell proliferation incubated for 72 hrs by CellTiter-Glo reagent based assay


J Med Chem 63: 5879-5955 (2020)


Article DOI: 10.1021/acs.jmedchem.0c00182
BindingDB Entry DOI: 10.7270/Q2MC93K8
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM168241
PNG
(US9669031, 69 8-fluoro-3,3-dimethyl-6-(pyrimidin-4...)
Show SMILES CC1(C)NC(=O)c2c(F)cc(Nc3ccncn3)c(=O)n12
Show InChI InChI=1S/C13H12FN5O2/c1-13(2)18-11(20)10-7(14)5-8(12(21)19(10)13)17-9-3-4-15-6-16-9/h3-6H,1-2H3,(H,18,20)(H,15,16,17)
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eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50263264
PNG
(CHEMBL4094080)
Show SMILES N[C@H]1C[C@@H](C1)Oc1ccc2ncc(-c3ccc4cnccc4c3)n2n1 |r,wU:3.5,wD:1.0,(36.72,-33.01,;35.21,-33.32,;33.93,-32.47,;33.08,-33.76,;34.37,-34.61,;31.57,-34.07,;30.55,-32.92,;29.04,-33.23,;28.03,-32.08,;28.51,-30.62,;27.74,-29.3,;28.77,-28.15,;30.18,-28.78,;31.51,-28.01,;31.51,-26.46,;32.84,-25.69,;34.17,-26.46,;35.5,-25.68,;36.83,-26.44,;36.84,-27.99,;35.51,-28.77,;34.17,-28,;32.84,-28.78,;30.01,-30.31,;31.04,-31.45,)|
Show InChI InChI=1S/C19H17N5O/c20-15-8-16(9-15)25-19-4-3-18-22-11-17(24(18)23-19)13-1-2-14-10-21-6-5-12(14)7-13/h1-7,10-11,15-16H,8-9,20H2/t15-,16-
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n/an/a 7.80n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM168239
PNG
(US9669031, 67 3,3,8-trimethyl-6-(pyrimidin-4-ylami...)
Show SMILES Cc1cc(Nc2ccncn2)c(=O)n2c1C(=O)NC2(C)C
Show InChI InChI=1S/C14H15N5O2/c1-8-6-9(17-10-4-5-15-7-16-10)13(21)19-11(8)12(20)18-14(19,2)3/h4-7H,1-3H3,(H,18,20)(H,15,16,17)
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n/an/a 10n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50576673
PNG
(CHEMBL4849769)
Show SMILES COc1cncc2O[C@]3([C@@H]([C@@H](CO)[C@H](CN4CCOCC4)[C@@]3(O)c12)c1ccccc1)c1ccc(Br)cc1 |r|
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n/an/a 10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of eIF4A (unknown origin) assessed as inhibition of translation of RNA featuring highly structured 5'-UTR of c-Myc


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128111
BindingDB Entry DOI: 10.7270/Q2GQ72K9
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50576672
PNG
(CHEMBL4857096)
Show SMILES COc1cncc2O[C@]3([C@@H]([C@@H](CO)[C@H](CNC4COC4)[C@@]3(O)c12)c1ccccc1)c1ccc(Br)cc1 |r|
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n/an/a 11n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of eIF4A (unknown origin) assessed as inhibition of translation of RNA featuring short 5'-UTR of tubulin


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128111
BindingDB Entry DOI: 10.7270/Q2GQ72K9
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM50263253
PNG
(CHEMBL4067557)
Show SMILES CC1(C)NC(=O)c2c(Cl)cc(Nc3cc(N)ncn3)c(=O)n12
Show InChI InChI=1S/C13H13ClN6O2/c1-13(2)19-11(21)10-6(14)3-7(12(22)20(10)13)18-9-4-8(15)16-5-17-9/h3-5H,1-2H3,(H,19,21)(H3,15,16,17,18)
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n/an/a 12n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM164271
PNG
(US9669031, 10 N-(6-((3,3-dimethyl-1,5-dioxo-1,2,3,...)
Show SMILES CC1(C)NC(=O)c2ccc(Nc3cc(NC(=O)C4CC4)ncn3)c(=O)n12
Show InChI InChI=1S/C17H18N6O3/c1-17(2)22-15(25)11-6-5-10(16(26)23(11)17)20-12-7-13(19-8-18-12)21-14(24)9-3-4-9/h5-9H,3-4H2,1-2H3,(H,22,25)(H2,18,19,20,21,24)
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n/an/a 12n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50540861
PNG
(EFT-226 | Eft226 | Zotatifin)
Show SMILES COc1cc2O[C@]3([C@@H]([C@@H](CN(C)C)[C@@H](O)[C@@]3(O)c2c(OC)n1)c1ccccc1)c1ccc(cc1)C#N
Show InChI InChI=1S/C28H29N3O5/c1-31(2)16-20-23(18-8-6-5-7-9-18)28(19-12-10-17(15-29)11-13-19)27(33,25(20)32)24-21(36-28)14-22(34-3)30-26(24)35-4/h5-14,20,23,25,32-33H,16H2,1-4H3/t20-,23-,25-,27+,28+/m1/s1
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n/an/a 14n/an/an/an/an/an/a



Inception Therapeutics

Curated by ChEMBL


Assay Description
Inhibition of eIF4A1 in human MDA-MB-231 cells assessed as inhibition of cellular-translation incubated for 4 hrs by specific tandem sequence motif r...


J Med Chem 63: 5879-5955 (2020)


Article DOI: 10.1021/acs.jmedchem.0c00182
BindingDB Entry DOI: 10.7270/Q2MC93K8
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM168239
PNG
(US9669031, 67 3,3,8-trimethyl-6-(pyrimidin-4-ylami...)
Show SMILES Cc1cc(Nc2ccncn2)c(=O)n2c1C(=O)NC2(C)C
Show InChI InChI=1S/C14H15N5O2/c1-8-6-9(17-10-4-5-15-7-16-10)13(21)19-11(8)12(20)18-14(19,2)3/h4-7H,1-3H3,(H,18,20)(H,15,16,17)
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n/an/a 19n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length N-terminal GST-tagged recombinant human MNK2 expressed in baculovirus expression system using Ac-TATKSGSTTKNR-NH2 as substr...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
Adenylate cyclase type 1


(Homo sapiens (Human))
BDBM50052137
PNG
(Acetic acid (3R,4aR,5S,6S,6aS,10S,10aR,10bS)-10,10...)
Show SMILES CC(=O)O[C@H]1[C@@H](OC(=O)NCCc2ccccn2)[C@H]2C(C)(C)CC[C@H](O)[C@]2(C)[C@@]2(O)C(=O)C[C@@](C)(O[C@]12C)C=C
Show InChI InChI=1S/C30H42N2O8/c1-8-27(5)17-21(35)30(37)28(6)20(34)12-14-26(3,4)23(28)22(24(38-18(2)33)29(30,7)40-27)39-25(36)32-16-13-19-11-9-10-15-31-19/h8-11,15,20,22-24,34,37H,1,12-14,16-17H2,2-7H3,(H,32,36)/t20-,22-,23-,24-,27-,28-,29+,30-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



Food and Drug Administration

Curated by ChEMBL


Assay Description
Inhibition of [125 I]-6-IHPP-forskolin binding to adenylate cyclase 1


J Med Chem 39: 2745-52 (1996)


Article DOI: 10.1021/jm960191+
BindingDB Entry DOI: 10.7270/Q2X34WJG
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50576670
PNG
(CHEMBL4864162)
Show SMILES COc1cncc2O[C@]3([C@@H](C[C@H](CN)[C@@]3(O)c12)c1ccccc1)c1ccc(Br)cc1 |r|
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n/an/a 21n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of eIF4A (unknown origin) assessed as inhibition of translation of RNA featuring short 5'-UTR of tubulin


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128111
BindingDB Entry DOI: 10.7270/Q2GQ72K9
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50576669
PNG
(CHEMBL4855528)
Show SMILES COc1cncc2O[C@]3([C@@H](C[C@H](CN)[C@@]3(O)c12)c1ccccc1)c1ccc(cc1)C#N |r|
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n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of eIF4A (unknown origin) assessed as inhibition of translation of RNA featuring short 5'-UTR of tubulin


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128111
BindingDB Entry DOI: 10.7270/Q2GQ72K9
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM297336
PNG
(5-((9H-purin-6-yl)amino)isoindolin-1-one (Cpd. No....)
Show SMILES O=C1NCc2cc(Nc3ncnc4[nH]cnc34)ccc12
Show InChI InChI=1S/C13H10N6O/c20-13-9-2-1-8(3-7(9)4-14-13)19-12-10-11(16-5-15-10)17-6-18-12/h1-3,5-6H,4H2,(H,14,20)(H2,15,16,17,18,19)
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n/an/a 23n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human MNK1 expressed in insect cells using Ac-TATKSGSTTKNR-NH2 as substrate preincubated for 5 mins ...


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1/2


(Homo sapiens (Human))
BDBM50263255
PNG
(CHEMBL4065802)
Show SMILES Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCC(F)(F)CC1
Show InChI InChI=1S/C17H18F2N6O2/c1-9-6-10(23-12-7-11(20)21-8-22-12)15(27)25-13(9)14(26)24-17(25)4-2-16(18,19)3-5-17/h6-8H,2-5H2,1H3,(H,24,26)(H3,20,21,22,23)
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n/an/a 24n/an/an/an/an/an/a



eFFECTOR Therapeutics , 11180 Roselle Street , San Diego , California 92121 , United States.

Curated by ChEMBL


Assay Description
Inhibition of MNK1/2 in human HCT116 cells assessed as decrease in eIF4E phosphorylation at Ser209 after 2 hrs by HTRF assay


J Med Chem 61: 3516-3540 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01795
BindingDB Entry DOI: 10.7270/Q2NC63PS
More data for this
Ligand-Target Pair
Eukaryotic initiation factor 4A-I


(Homo sapiens (Human))
BDBM50576671
PNG
(CHEMBL4875109)
Show SMILES COc1cncc2O[C@]3([C@@H]([C@@H](CO)[C@H](CN)[C@@]3(O)c12)c1ccccc1)c1ccc(Br)cc1 |r|
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n/an/a 25n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of eIF4A (unknown origin) assessed as inhibition of translation of RNA featuring highly structured 5'-UTR of c-Myc


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128111
BindingDB Entry DOI: 10.7270/Q2GQ72K9
More data for this
Ligand-Target Pair
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