Found 56 hits Enz. Inhib. hit(s) with all data for entry = 50044595 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021658
(CHEMBL3298194)Show SMILES COc1cc(Nc2nc3cccc(-c4cccc5[nH]cnc45)c3o2)cc(OC)c1OC Show InChI InChI=1S/C23H20N4O4/c1-28-18-10-13(11-19(29-2)22(18)30-3)26-23-27-17-9-5-7-15(21(17)31-23)14-6-4-8-16-20(14)25-12-24-16/h4-12H,1-3H3,(H,24,25)(H,26,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021659
(CHEMBL3297951)Show SMILES COc1ccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc1O[C@H]1CCNC1 |r,wU:28.31,(10.88,-23.43,;12.42,-23.43,;13.19,-22.09,;12.42,-20.76,;13.19,-19.42,;14.73,-19.43,;15.5,-18.1,;17.04,-18.1,;17.95,-16.86,;19.41,-17.33,;20.74,-16.56,;22.07,-17.32,;22.08,-18.87,;20.74,-19.65,;20.75,-21.19,;19.42,-21.96,;18.08,-21.18,;19.42,-23.49,;20.75,-24.27,;22.09,-23.49,;22.08,-21.95,;23.41,-21.18,;24.75,-21.94,;19.41,-18.87,;17.94,-19.35,;15.5,-20.76,;14.73,-22.09,;15.51,-23.42,;14.74,-24.76,;15.37,-26.16,;14.23,-27.2,;12.89,-26.43,;13.21,-24.92,)| Show InChI InChI=1S/C25H24FN3O4/c1-30-20-10-9-15(13-22(20)32-16-11-12-27-14-16)28-25-29-19-7-3-5-17(24(19)33-25)23-18(26)6-4-8-21(23)31-2/h3-10,13,16,27H,11-12,14H2,1-2H3,(H,28,29)/t16-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021660
(CHEMBL3297945)Show SMILES COc1cc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc(OC)c1OC |(15.44,-24.81,;16.21,-23.48,;15.43,-22.15,;16.2,-20.81,;15.43,-19.49,;16.2,-18.15,;17.74,-18.16,;18.65,-16.91,;20.11,-17.39,;21.44,-16.61,;22.78,-17.38,;22.78,-18.93,;21.44,-19.7,;21.45,-21.25,;20.12,-22.01,;18.79,-21.24,;20.12,-23.55,;21.45,-24.32,;22.79,-23.54,;22.78,-22.01,;24.12,-21.23,;25.45,-22,;20.11,-18.93,;18.65,-19.4,;13.89,-19.48,;13.12,-20.81,;11.58,-20.81,;10.81,-19.47,;13.89,-22.15,;13.12,-23.48,;11.58,-23.48,)| Show InChI InChI=1S/C23H21FN2O5/c1-27-17-10-6-8-15(24)20(17)14-7-5-9-16-21(14)31-23(26-16)25-13-11-18(28-2)22(30-4)19(12-13)29-3/h5-12H,1-4H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021661
(CHEMBL3298039)Show SMILES COc1ccccc1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 Show InChI InChI=1S/C23H22N2O5/c1-26-18-11-6-5-8-15(18)16-9-7-10-17-21(16)30-23(25-17)24-14-12-19(27-2)22(29-4)20(13-14)28-3/h5-13H,1-4H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021662
(CHEMBL3298045)Show SMILES COc1ccc(F)cc1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 Show InChI InChI=1S/C23H21FN2O5/c1-27-18-9-8-13(24)10-16(18)15-6-5-7-17-21(15)31-23(26-17)25-14-11-19(28-2)22(30-4)20(12-14)29-3/h5-12H,1-4H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021663
(CHEMBL3298046)Show SMILES COc1cc(Nc2nc3cccc(-c4ccc(C)cc4OC)c3o2)cc(OC)c1OC Show InChI InChI=1S/C24H24N2O5/c1-14-9-10-16(19(11-14)27-2)17-7-6-8-18-22(17)31-24(26-18)25-15-12-20(28-3)23(30-5)21(13-15)29-4/h6-13H,1-5H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021664
(CHEMBL3298193)Show SMILES COc1cc(Nc2nc3cccc(-c4cccc5cn[nH]c45)c3o2)cc(OC)c1OC Show InChI InChI=1S/C23H20N4O4/c1-28-18-10-14(11-19(29-2)22(18)30-3)25-23-26-17-9-5-8-16(21(17)31-23)15-7-4-6-13-12-24-27-20(13)15/h4-12H,1-3H3,(H,24,27)(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021665
(CHEMBL3297948)Show SMILES COc1ccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc1OC |(11.58,-23.48,;13.12,-23.48,;13.89,-22.15,;13.12,-20.81,;13.89,-19.48,;15.43,-19.49,;16.2,-18.15,;17.74,-18.16,;18.65,-16.91,;20.11,-17.39,;21.44,-16.61,;22.78,-17.38,;22.78,-18.93,;21.45,-19.7,;21.45,-21.25,;20.12,-22.01,;18.79,-21.24,;20.12,-23.55,;21.45,-24.32,;22.79,-23.55,;22.79,-22.01,;24.12,-21.23,;25.45,-22,;20.11,-18.93,;18.65,-19.4,;16.2,-20.81,;15.44,-22.15,;16.21,-23.48,;15.44,-24.81,)| Show InChI InChI=1S/C22H19FN2O4/c1-26-17-11-10-13(12-19(17)28-3)24-22-25-16-8-4-6-14(21(16)29-22)20-15(23)7-5-9-18(20)27-2/h4-12H,1-3H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021666
(CHEMBL3297947)Show SMILES COc1cc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc(OC)c1 |(10.81,-19.47,;11.58,-20.81,;13.12,-20.81,;13.89,-19.48,;15.43,-19.49,;16.2,-18.15,;17.74,-18.16,;18.65,-16.91,;20.11,-17.39,;21.44,-16.61,;22.78,-17.38,;22.78,-18.93,;21.45,-19.7,;21.45,-21.25,;20.12,-22.01,;18.79,-21.24,;20.12,-23.55,;21.45,-24.32,;22.79,-23.55,;22.79,-22.01,;24.12,-21.23,;25.45,-22,;20.11,-18.93,;18.65,-19.4,;16.2,-20.81,;15.44,-22.15,;16.21,-23.48,;15.44,-24.81,;13.89,-22.15,)| Show InChI InChI=1S/C22H19FN2O4/c1-26-14-10-13(11-15(12-14)27-2)24-22-25-18-8-4-6-16(21(18)29-22)20-17(23)7-5-9-19(20)28-3/h4-12H,1-3H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021667
(CHEMBL3297950)Show SMILES COc1ccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc1N |(11.58,-23.49,;13.12,-23.49,;13.89,-22.16,;13.12,-20.82,;13.9,-19.49,;15.44,-19.49,;16.21,-18.16,;17.75,-18.16,;18.66,-16.92,;20.12,-17.4,;21.45,-16.62,;22.78,-17.38,;22.79,-18.93,;21.45,-19.71,;21.46,-21.25,;20.13,-22.02,;18.79,-21.25,;20.12,-23.56,;21.46,-24.33,;22.8,-23.55,;22.79,-22.02,;24.12,-21.24,;25.46,-22,;20.12,-18.94,;18.65,-19.41,;16.21,-20.82,;15.44,-22.15,;16.21,-23.49,)| Show InChI InChI=1S/C21H18FN3O3/c1-26-17-10-9-12(11-15(17)23)24-21-25-16-7-3-5-13(20(16)28-21)19-14(22)6-4-8-18(19)27-2/h3-11H,23H2,1-2H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021668
(CHEMBL3298040)Show SMILES COc1cc(Nc2nc3cccc(-c4ccccc4F)c3o2)cc(OC)c1OC Show InChI InChI=1S/C22H19FN2O4/c1-26-18-11-13(12-19(27-2)21(18)28-3)24-22-25-17-10-6-8-15(20(17)29-22)14-7-4-5-9-16(14)23/h4-12H,1-3H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021669
(CHEMBL3297949)Show SMILES COc1cccc(F)c1-c1cccc2nc(Nc3cccc(c3)S(N)(=O)=O)oc12 |(25.47,-22.01,;24.13,-21.25,;22.8,-22.02,;22.81,-23.56,;21.47,-24.34,;20.13,-23.57,;20.13,-22.03,;18.8,-21.25,;21.47,-21.26,;21.46,-19.72,;22.8,-18.94,;22.79,-17.39,;21.45,-16.62,;20.13,-17.4,;18.66,-16.92,;17.75,-18.17,;16.21,-18.17,;15.44,-19.5,;16.21,-20.83,;15.45,-22.16,;13.9,-22.16,;13.13,-20.83,;13.9,-19.49,;11.59,-20.82,;10.82,-19.49,;11.98,-22.31,;10.24,-21.58,;18.66,-19.41,;20.12,-18.94,)| Show InChI InChI=1S/C20H16FN3O4S/c1-27-17-10-4-8-15(21)18(17)14-7-3-9-16-19(14)28-20(24-16)23-12-5-2-6-13(11-12)29(22,25)26/h2-11H,1H3,(H,23,24)(H2,22,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021670
(CHEMBL3297840)Show SMILES COc1cccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)c1 |(6.37,-11.94,;7.13,-10.6,;6.36,-9.27,;4.81,-9.27,;4.04,-7.94,;4.82,-6.6,;6.36,-6.61,;7.13,-5.28,;8.67,-5.28,;9.58,-4.03,;11.04,-4.51,;12.37,-3.74,;13.71,-4.5,;13.71,-6.05,;12.38,-6.82,;12.37,-8.36,;11.04,-9.13,;9.71,-8.36,;11.04,-10.67,;12.37,-11.44,;13.71,-10.66,;13.71,-9.13,;15.04,-8.35,;16.38,-9.11,;11.04,-6.05,;9.57,-6.53,;7.13,-7.94,)| Show InChI InChI=1S/C21H17FN2O3/c1-25-14-7-3-6-13(12-14)23-21-24-17-10-4-8-15(20(17)27-21)19-16(22)9-5-11-18(19)26-2/h3-12H,1-2H3,(H,23,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 410 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50021658
(CHEMBL3298194)Show SMILES COc1cc(Nc2nc3cccc(-c4cccc5[nH]cnc45)c3o2)cc(OC)c1OC Show InChI InChI=1S/C23H20N4O4/c1-28-18-10-13(11-19(29-2)22(18)30-3)26-23-27-17-9-5-7-15(21(17)31-23)14-6-4-8-16-20(14)25-12-24-16/h4-12H,1-3H3,(H,24,25)(H,26,27) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 460 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of JAK2 (unknown origin) |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021671
(CHEMBL3298042)Show SMILES CCOc1cccc(F)c1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 |(22.28,-22.22,;20.95,-23,;19.61,-22.24,;18.28,-23.01,;18.29,-24.55,;16.95,-25.33,;15.61,-24.55,;15.61,-23.01,;14.28,-22.24,;16.95,-22.25,;16.94,-20.71,;18.28,-19.93,;18.27,-18.38,;16.94,-17.62,;15.61,-18.39,;14.15,-17.92,;13.24,-19.16,;11.7,-19.16,;10.93,-20.49,;11.7,-21.82,;10.93,-23.15,;11.7,-24.48,;10.94,-25.82,;9.38,-23.15,;8.61,-24.48,;7.07,-24.48,;8.61,-21.81,;7.07,-21.81,;6.31,-20.48,;9.39,-20.48,;14.14,-20.4,;15.61,-19.93,)| Show InChI InChI=1S/C24H23FN2O5/c1-5-31-18-11-7-9-16(25)21(18)15-8-6-10-17-22(15)32-24(27-17)26-14-12-19(28-2)23(30-4)20(13-14)29-3/h6-13H,5H2,1-4H3,(H,26,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 490 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021672
(CHEMBL3298192)Show SMILES COc1cc(Nc2nc3cccc(-c4nc(C)[nH]c4C)c3o2)cc(OC)c1OC Show InChI InChI=1S/C21H22N4O4/c1-11-18(23-12(2)22-11)14-7-6-8-15-19(14)29-21(25-15)24-13-9-16(26-3)20(28-5)17(10-13)27-4/h6-10H,1-5H3,(H,22,23)(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 560 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50021658
(CHEMBL3298194)Show SMILES COc1cc(Nc2nc3cccc(-c4cccc5[nH]cnc45)c3o2)cc(OC)c1OC Show InChI InChI=1S/C23H20N4O4/c1-28-18-10-13(11-19(29-2)22(18)30-3)26-23-27-17-9-5-7-15(21(17)31-23)14-6-4-8-16-20(14)25-12-24-16/h4-12H,1-3H3,(H,24,25)(H,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of aurora A (unknown origin) |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021673
(CHEMBL3297843)Show SMILES COc1cccc(F)c1-c1cccc2nc(NC3CCCCC3)oc12 |(17.2,-8.09,;15.86,-7.32,;14.53,-8.1,;14.54,-9.64,;13.2,-10.41,;11.86,-9.64,;11.87,-8.1,;10.53,-7.33,;13.2,-7.34,;13.2,-5.8,;14.54,-5.02,;14.53,-3.47,;13.2,-2.71,;11.87,-3.48,;10.4,-3.01,;9.5,-4.25,;7.96,-4.25,;7.18,-5.58,;5.64,-5.58,;4.87,-6.91,;5.64,-8.25,;7.19,-8.24,;7.95,-6.91,;10.4,-5.5,;11.86,-5.02,)| Show InChI InChI=1S/C20H21FN2O2/c1-24-17-12-6-10-15(21)18(17)14-9-5-11-16-19(14)25-20(23-16)22-13-7-3-2-4-8-13/h5-6,9-13H,2-4,7-8H2,1H3,(H,22,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 620 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021674
(CHEMBL3297845)Show SMILES COc1cccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)n1 |(6.31,-22.33,;7.08,-20.99,;6.3,-19.66,;4.75,-19.67,;3.99,-18.33,;4.76,-17,;6.3,-17,;7.07,-15.67,;8.61,-15.67,;9.52,-14.43,;10.98,-14.91,;12.31,-14.13,;13.64,-14.9,;13.65,-16.45,;12.31,-17.22,;12.31,-18.76,;10.98,-19.52,;9.65,-18.75,;10.98,-21.06,;12.31,-21.83,;13.65,-21.05,;13.64,-19.52,;14.97,-18.74,;16.31,-19.51,;10.98,-16.45,;9.51,-16.92,;7.07,-18.33,)| Show InChI InChI=1S/C20H16FN3O3/c1-25-15-9-4-7-13(21)18(15)12-6-3-8-14-19(12)27-20(22-14)24-16-10-5-11-17(23-16)26-2/h3-11H,1-2H3,(H,22,23,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 620 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021675
(CHEMBL3297846)Show SMILES CCOc1cccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)c1 |(7.08,-23.66,;6.31,-22.33,;7.08,-21,;6.3,-19.66,;4.75,-19.67,;3.99,-18.33,;4.76,-17,;6.3,-17,;7.07,-15.67,;8.61,-15.67,;9.52,-14.43,;10.98,-14.91,;12.31,-14.13,;13.64,-14.9,;13.65,-16.45,;12.31,-17.22,;12.31,-18.76,;10.98,-19.52,;9.65,-18.75,;10.98,-21.06,;12.31,-21.83,;13.65,-21.05,;13.64,-19.52,;14.97,-18.74,;16.31,-19.51,;10.98,-16.45,;9.51,-16.92,;7.07,-18.33,)| Show InChI InChI=1S/C22H19FN2O3/c1-3-27-15-8-4-7-14(13-15)24-22-25-18-11-5-9-16(21(18)28-22)20-17(23)10-6-12-19(20)26-2/h4-13H,3H2,1-2H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 730 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021658
(CHEMBL3298194)Show SMILES COc1cc(Nc2nc3cccc(-c4cccc5[nH]cnc45)c3o2)cc(OC)c1OC Show InChI InChI=1S/C23H20N4O4/c1-28-18-10-13(11-19(29-2)22(18)30-3)26-23-27-17-9-5-7-15(21(17)31-23)14-6-4-8-16-20(14)25-12-24-16/h4-12H,1-3H3,(H,24,25)(H,26,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 800 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021676
(CHEMBL3298043)Show SMILES COc1cc(Nc2nc3cccc(-c4c(F)cccc4OC(C)C)c3o2)cc(OC)c1OC |(10.96,-25.92,;11.73,-24.58,;10.95,-23.25,;11.72,-21.92,;10.95,-20.59,;11.72,-19.26,;13.26,-19.26,;14.17,-18.02,;15.63,-18.49,;16.96,-17.72,;18.29,-18.48,;18.3,-20.03,;16.96,-20.81,;16.97,-22.35,;15.64,-23.11,;14.3,-22.34,;15.64,-24.65,;16.97,-25.43,;18.31,-24.65,;18.3,-23.11,;19.63,-22.34,;20.97,-23.1,;22.3,-22.32,;20.98,-24.64,;15.63,-20.03,;14.16,-20.51,;9.41,-20.58,;8.64,-21.91,;7.1,-21.91,;6.33,-20.58,;9.41,-23.25,;8.64,-24.58,;7.1,-24.58,)| Show InChI InChI=1S/C25H25FN2O5/c1-14(2)32-19-11-7-9-17(26)22(19)16-8-6-10-18-23(16)33-25(28-18)27-15-12-20(29-3)24(31-5)21(13-15)30-4/h6-14H,1-5H3,(H,27,28) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 970 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021677
(CHEMBL3297842)Show SMILES COc1cccc(F)c1-c1cccc2nc(Nc3ccccc3)oc12 |(17.2,-8.09,;15.86,-7.32,;14.53,-8.1,;14.54,-9.64,;13.2,-10.41,;11.86,-9.64,;11.87,-8.1,;10.53,-7.33,;13.2,-7.34,;13.2,-5.8,;14.54,-5.02,;14.53,-3.47,;13.2,-2.71,;11.87,-3.48,;10.4,-3.01,;9.5,-4.25,;7.96,-4.25,;7.18,-5.58,;5.64,-5.58,;4.87,-6.91,;5.64,-8.25,;7.19,-8.24,;7.95,-6.91,;10.4,-5.5,;11.86,-5.02,)| Show InChI InChI=1S/C20H15FN2O2/c1-24-17-12-6-10-15(21)18(17)14-9-5-11-16-19(14)25-20(23-16)22-13-7-3-2-4-8-13/h2-12H,1H3,(H,22,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021678
(CHEMBL3298047)Show SMILES COc1ccc(C)cc1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 Show InChI InChI=1S/C24H24N2O5/c1-14-9-10-19(27-2)17(11-14)16-7-6-8-18-22(16)31-24(26-18)25-15-12-20(28-3)23(30-5)21(13-15)29-4/h6-13H,1-5H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021679
(CHEMBL3298044)Show SMILES COc1cccc(OC)c1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 |(21.55,-22.88,;20.22,-22.11,;18.89,-22.89,;18.89,-24.42,;17.55,-25.2,;16.22,-24.43,;16.22,-22.89,;14.89,-22.12,;13.55,-22.89,;17.55,-22.13,;17.55,-20.58,;18.88,-19.81,;18.88,-18.26,;17.54,-17.49,;16.21,-18.27,;14.75,-17.79,;13.85,-19.03,;12.31,-19.03,;11.53,-20.37,;12.3,-21.69,;11.54,-23.02,;12.31,-24.36,;11.54,-25.69,;9.99,-23.03,;9.22,-24.36,;7.68,-24.36,;9.22,-21.69,;7.68,-21.69,;6.91,-20.35,;9.99,-20.36,;14.75,-20.28,;16.21,-19.81,)| Show InChI InChI=1S/C24H24N2O6/c1-27-17-10-7-11-18(28-2)21(17)15-8-6-9-16-22(15)32-24(26-16)25-14-12-19(29-3)23(31-5)20(13-14)30-4/h6-13H,1-5H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021680
(CHEMBL3297946)Show SMILES COc1ccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc1 |(11.58,-23.5,;13.13,-23.5,;13.9,-22.16,;13.13,-20.83,;13.9,-19.49,;15.44,-19.5,;16.21,-18.17,;17.75,-18.17,;18.66,-16.92,;20.13,-17.4,;21.45,-16.62,;22.79,-17.39,;22.8,-18.94,;21.46,-19.72,;21.47,-21.26,;20.13,-22.03,;18.8,-21.25,;20.13,-23.57,;21.47,-24.34,;22.81,-23.56,;22.8,-22.02,;24.13,-21.25,;25.47,-22.01,;20.12,-18.94,;18.66,-19.41,;16.21,-20.83,;15.45,-22.16,)| Show InChI InChI=1S/C21H17FN2O3/c1-25-14-11-9-13(10-12-14)23-21-24-17-7-3-5-15(20(17)27-21)19-16(22)6-4-8-18(19)26-2/h3-12H,1-2H3,(H,23,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021660
(CHEMBL3297945)Show SMILES COc1cc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc(OC)c1OC |(15.44,-24.81,;16.21,-23.48,;15.43,-22.15,;16.2,-20.81,;15.43,-19.49,;16.2,-18.15,;17.74,-18.16,;18.65,-16.91,;20.11,-17.39,;21.44,-16.61,;22.78,-17.38,;22.78,-18.93,;21.44,-19.7,;21.45,-21.25,;20.12,-22.01,;18.79,-21.24,;20.12,-23.55,;21.45,-24.32,;22.79,-23.54,;22.78,-22.01,;24.12,-21.23,;25.45,-22,;20.11,-18.93,;18.65,-19.4,;13.89,-19.48,;13.12,-20.81,;11.58,-20.81,;10.81,-19.47,;13.89,-22.15,;13.12,-23.48,;11.58,-23.48,)| Show InChI InChI=1S/C23H21FN2O5/c1-27-17-10-6-8-15(24)20(17)14-7-5-9-16-21(14)31-23(26-16)25-13-11-18(28-2)22(30-4)19(12-13)29-3/h5-12H,1-4H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021681
(CHEMBL3297841)Show SMILES COc1cccc(F)c1-c1cccc2nc(N)oc12 |(16.32,-19.52,;14.99,-18.76,;13.65,-19.53,;13.66,-21.07,;12.32,-21.85,;10.98,-21.08,;10.99,-19.54,;9.65,-18.76,;12.32,-18.77,;12.32,-17.23,;13.66,-16.46,;13.65,-14.91,;12.32,-14.14,;10.99,-14.92,;9.52,-14.44,;8.62,-15.68,;7.08,-15.68,;9.52,-16.93,;10.99,-16.46,)| Show InChI InChI=1S/C14H11FN2O2/c1-18-11-7-3-5-9(15)12(11)8-4-2-6-10-13(8)19-14(16)17-10/h2-7H,1H3,(H2,16,17) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021682
(CHEMBL3297844)Show SMILES COc1cccc(F)c1-c1cccc2nc(NC3CCOCC3)oc12 |(17.2,-8.09,;15.86,-7.32,;14.53,-8.1,;14.54,-9.64,;13.2,-10.41,;11.86,-9.64,;11.87,-8.1,;10.53,-7.33,;13.2,-7.34,;13.2,-5.8,;14.54,-5.02,;14.53,-3.47,;13.2,-2.71,;11.87,-3.48,;10.4,-3.01,;9.5,-4.25,;7.96,-4.25,;7.18,-5.58,;5.64,-5.58,;4.87,-6.91,;5.64,-8.25,;7.19,-8.24,;7.95,-6.91,;10.4,-5.5,;11.86,-5.02,)| Show InChI InChI=1S/C19H19FN2O3/c1-23-16-7-3-5-14(20)17(16)13-4-2-6-15-18(13)25-19(22-15)21-12-8-10-24-11-9-12/h2-7,12H,8-11H2,1H3,(H,21,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021662
(CHEMBL3298045)Show SMILES COc1ccc(F)cc1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 Show InChI InChI=1S/C23H21FN2O5/c1-27-18-9-8-13(24)10-16(18)15-6-5-7-17-21(15)31-23(26-17)25-14-11-19(28-2)22(30-4)20(12-14)29-3/h5-12H,1-4H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021683
(CHEMBL3298041)Show SMILES COc1cc(Nc2nc3cccc(-c4ccccc4OC(F)(F)F)c3o2)cc(OC)c1OC Show InChI InChI=1S/C23H19F3N2O5/c1-29-18-11-13(12-19(30-2)21(18)31-3)27-22-28-16-9-6-8-15(20(16)32-22)14-7-4-5-10-17(14)33-23(24,25)26/h4-12H,1-3H3,(H,27,28) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021661
(CHEMBL3298039)Show SMILES COc1ccccc1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 Show InChI InChI=1S/C23H22N2O5/c1-26-18-11-6-5-8-15(18)16-9-7-10-17-21(16)30-23(25-17)24-14-12-19(27-2)22(29-4)20(13-14)28-3/h5-13H,1-4H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021664
(CHEMBL3298193)Show SMILES COc1cc(Nc2nc3cccc(-c4cccc5cn[nH]c45)c3o2)cc(OC)c1OC Show InChI InChI=1S/C23H20N4O4/c1-28-18-10-14(11-19(29-2)22(18)30-3)25-23-26-17-9-5-8-16(21(17)31-23)15-7-4-6-13-12-24-27-20(13)15/h4-12H,1-3H3,(H,24,27)(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021659
(CHEMBL3297951)Show SMILES COc1ccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc1O[C@H]1CCNC1 |r,wU:28.31,(10.88,-23.43,;12.42,-23.43,;13.19,-22.09,;12.42,-20.76,;13.19,-19.42,;14.73,-19.43,;15.5,-18.1,;17.04,-18.1,;17.95,-16.86,;19.41,-17.33,;20.74,-16.56,;22.07,-17.32,;22.08,-18.87,;20.74,-19.65,;20.75,-21.19,;19.42,-21.96,;18.08,-21.18,;19.42,-23.49,;20.75,-24.27,;22.09,-23.49,;22.08,-21.95,;23.41,-21.18,;24.75,-21.94,;19.41,-18.87,;17.94,-19.35,;15.5,-20.76,;14.73,-22.09,;15.51,-23.42,;14.74,-24.76,;15.37,-26.16,;14.23,-27.2,;12.89,-26.43,;13.21,-24.92,)| Show InChI InChI=1S/C25H24FN3O4/c1-30-20-10-9-15(13-22(20)32-16-11-12-27-14-16)28-25-29-19-7-3-5-17(24(19)33-25)23-18(26)6-4-8-21(23)31-2/h3-10,13,16,27H,11-12,14H2,1-2H3,(H,28,29)/t16-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021665
(CHEMBL3297948)Show SMILES COc1ccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc1OC |(11.58,-23.48,;13.12,-23.48,;13.89,-22.15,;13.12,-20.81,;13.89,-19.48,;15.43,-19.49,;16.2,-18.15,;17.74,-18.16,;18.65,-16.91,;20.11,-17.39,;21.44,-16.61,;22.78,-17.38,;22.78,-18.93,;21.45,-19.7,;21.45,-21.25,;20.12,-22.01,;18.79,-21.24,;20.12,-23.55,;21.45,-24.32,;22.79,-23.55,;22.79,-22.01,;24.12,-21.23,;25.45,-22,;20.11,-18.93,;18.65,-19.4,;16.2,-20.81,;15.44,-22.15,;16.21,-23.48,;15.44,-24.81,)| Show InChI InChI=1S/C22H19FN2O4/c1-26-17-11-10-13(12-19(17)28-3)24-22-25-16-8-4-6-14(21(16)29-22)20-15(23)7-5-9-18(20)27-2/h4-12H,1-3H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021684
(CHEMBL3298191)Show SMILES COc1cc(Nc2nc3cccc(-c4ccccc4-c4cn[nH]c4)c3o2)cc(OC)c1OC Show InChI InChI=1S/C25H22N4O4/c1-30-21-11-16(12-22(31-2)24(21)32-3)28-25-29-20-10-6-9-19(23(20)33-25)18-8-5-4-7-17(18)15-13-26-27-14-15/h4-14H,1-3H3,(H,26,27)(H,28,29) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 9.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of recombinant full length RSK2 (unknown origin) using biotin-AGAGRSRHSSYPAGT-OH as substrate after 150 mins |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021663
(CHEMBL3298046)Show SMILES COc1cc(Nc2nc3cccc(-c4ccc(C)cc4OC)c3o2)cc(OC)c1OC Show InChI InChI=1S/C24H24N2O5/c1-14-9-10-16(19(11-14)27-2)17-7-6-8-18-22(17)31-24(26-18)25-15-12-20(28-3)23(30-5)21(13-15)29-4/h6-13H,1-5H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 9.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021671
(CHEMBL3298042)Show SMILES CCOc1cccc(F)c1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 |(22.28,-22.22,;20.95,-23,;19.61,-22.24,;18.28,-23.01,;18.29,-24.55,;16.95,-25.33,;15.61,-24.55,;15.61,-23.01,;14.28,-22.24,;16.95,-22.25,;16.94,-20.71,;18.28,-19.93,;18.27,-18.38,;16.94,-17.62,;15.61,-18.39,;14.15,-17.92,;13.24,-19.16,;11.7,-19.16,;10.93,-20.49,;11.7,-21.82,;10.93,-23.15,;11.7,-24.48,;10.94,-25.82,;9.38,-23.15,;8.61,-24.48,;7.07,-24.48,;8.61,-21.81,;7.07,-21.81,;6.31,-20.48,;9.39,-20.48,;14.14,-20.4,;15.61,-19.93,)| Show InChI InChI=1S/C24H23FN2O5/c1-5-31-18-11-7-9-16(25)21(18)15-8-6-10-17-22(15)32-24(27-17)26-14-12-19(28-2)23(30-4)20(13-14)29-3/h6-13H,5H2,1-4H3,(H,26,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.08E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021678
(CHEMBL3298047)Show SMILES COc1ccc(C)cc1-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12 Show InChI InChI=1S/C24H24N2O5/c1-14-9-10-19(27-2)17(11-14)16-7-6-8-18-22(16)31-24(26-18)25-15-12-20(28-3)23(30-5)21(13-15)29-4/h6-13H,1-5H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.45E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021670
(CHEMBL3297840)Show SMILES COc1cccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)c1 |(6.37,-11.94,;7.13,-10.6,;6.36,-9.27,;4.81,-9.27,;4.04,-7.94,;4.82,-6.6,;6.36,-6.61,;7.13,-5.28,;8.67,-5.28,;9.58,-4.03,;11.04,-4.51,;12.37,-3.74,;13.71,-4.5,;13.71,-6.05,;12.38,-6.82,;12.37,-8.36,;11.04,-9.13,;9.71,-8.36,;11.04,-10.67,;12.37,-11.44,;13.71,-10.66,;13.71,-9.13,;15.04,-8.35,;16.38,-9.11,;11.04,-6.05,;9.57,-6.53,;7.13,-7.94,)| Show InChI InChI=1S/C21H17FN2O3/c1-25-14-7-3-6-13(12-14)23-21-24-17-10-4-8-15(20(17)27-21)19-16(22)9-5-11-18(19)26-2/h3-12H,1-2H3,(H,23,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.54E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021666
(CHEMBL3297947)Show SMILES COc1cc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc(OC)c1 |(10.81,-19.47,;11.58,-20.81,;13.12,-20.81,;13.89,-19.48,;15.43,-19.49,;16.2,-18.15,;17.74,-18.16,;18.65,-16.91,;20.11,-17.39,;21.44,-16.61,;22.78,-17.38,;22.78,-18.93,;21.45,-19.7,;21.45,-21.25,;20.12,-22.01,;18.79,-21.24,;20.12,-23.55,;21.45,-24.32,;22.79,-23.55,;22.79,-22.01,;24.12,-21.23,;25.45,-22,;20.11,-18.93,;18.65,-19.4,;16.2,-20.81,;15.44,-22.15,;16.21,-23.48,;15.44,-24.81,;13.89,-22.15,)| Show InChI InChI=1S/C22H19FN2O4/c1-26-14-10-13(11-15(12-14)27-2)24-22-25-18-8-4-6-16(21(18)29-22)20-17(23)7-5-9-19(20)28-3/h4-12H,1-3H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.72E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021668
(CHEMBL3298040)Show SMILES COc1cc(Nc2nc3cccc(-c4ccccc4F)c3o2)cc(OC)c1OC Show InChI InChI=1S/C22H19FN2O4/c1-26-18-11-13(12-19(27-2)21(18)28-3)24-22-25-17-10-6-8-15(20(17)29-22)14-7-4-5-9-16(14)23/h4-12H,1-3H3,(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021672
(CHEMBL3298192)Show SMILES COc1cc(Nc2nc3cccc(-c4nc(C)[nH]c4C)c3o2)cc(OC)c1OC Show InChI InChI=1S/C21H22N4O4/c1-11-18(23-12(2)22-11)14-7-6-8-15-19(14)29-21(25-15)24-13-9-16(26-3)20(28-5)17(10-13)27-4/h6-10H,1-5H3,(H,22,23)(H,24,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.98E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021677
(CHEMBL3297842)Show SMILES COc1cccc(F)c1-c1cccc2nc(Nc3ccccc3)oc12 |(17.2,-8.09,;15.86,-7.32,;14.53,-8.1,;14.54,-9.64,;13.2,-10.41,;11.86,-9.64,;11.87,-8.1,;10.53,-7.33,;13.2,-7.34,;13.2,-5.8,;14.54,-5.02,;14.53,-3.47,;13.2,-2.71,;11.87,-3.48,;10.4,-3.01,;9.5,-4.25,;7.96,-4.25,;7.18,-5.58,;5.64,-5.58,;4.87,-6.91,;5.64,-8.25,;7.19,-8.24,;7.95,-6.91,;10.4,-5.5,;11.86,-5.02,)| Show InChI InChI=1S/C20H15FN2O2/c1-24-17-12-6-10-15(21)18(17)14-9-5-11-16-19(14)25-20(23-16)22-13-7-3-2-4-8-13/h2-12H,1H3,(H,22,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021673
(CHEMBL3297843)Show SMILES COc1cccc(F)c1-c1cccc2nc(NC3CCCCC3)oc12 |(17.2,-8.09,;15.86,-7.32,;14.53,-8.1,;14.54,-9.64,;13.2,-10.41,;11.86,-9.64,;11.87,-8.1,;10.53,-7.33,;13.2,-7.34,;13.2,-5.8,;14.54,-5.02,;14.53,-3.47,;13.2,-2.71,;11.87,-3.48,;10.4,-3.01,;9.5,-4.25,;7.96,-4.25,;7.18,-5.58,;5.64,-5.58,;4.87,-6.91,;5.64,-8.25,;7.19,-8.24,;7.95,-6.91,;10.4,-5.5,;11.86,-5.02,)| Show InChI InChI=1S/C20H21FN2O2/c1-24-17-12-6-10-15(21)18(17)14-9-5-11-16-19(14)25-20(23-16)22-13-7-3-2-4-8-13/h5-6,9-13H,2-4,7-8H2,1H3,(H,22,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021682
(CHEMBL3297844)Show SMILES COc1cccc(F)c1-c1cccc2nc(NC3CCOCC3)oc12 |(17.2,-8.09,;15.86,-7.32,;14.53,-8.1,;14.54,-9.64,;13.2,-10.41,;11.86,-9.64,;11.87,-8.1,;10.53,-7.33,;13.2,-7.34,;13.2,-5.8,;14.54,-5.02,;14.53,-3.47,;13.2,-2.71,;11.87,-3.48,;10.4,-3.01,;9.5,-4.25,;7.96,-4.25,;7.18,-5.58,;5.64,-5.58,;4.87,-6.91,;5.64,-8.25,;7.19,-8.24,;7.95,-6.91,;10.4,-5.5,;11.86,-5.02,)| Show InChI InChI=1S/C19H19FN2O3/c1-23-16-7-3-5-14(20)17(16)13-4-2-6-15-18(13)25-19(22-15)21-12-8-10-24-11-9-12/h2-7,12H,8-11H2,1H3,(H,21,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021674
(CHEMBL3297845)Show SMILES COc1cccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)n1 |(6.31,-22.33,;7.08,-20.99,;6.3,-19.66,;4.75,-19.67,;3.99,-18.33,;4.76,-17,;6.3,-17,;7.07,-15.67,;8.61,-15.67,;9.52,-14.43,;10.98,-14.91,;12.31,-14.13,;13.64,-14.9,;13.65,-16.45,;12.31,-17.22,;12.31,-18.76,;10.98,-19.52,;9.65,-18.75,;10.98,-21.06,;12.31,-21.83,;13.65,-21.05,;13.64,-19.52,;14.97,-18.74,;16.31,-19.51,;10.98,-16.45,;9.51,-16.92,;7.07,-18.33,)| Show InChI InChI=1S/C20H16FN3O3/c1-25-15-9-4-7-13(21)18(15)12-6-3-8-14-19(12)27-20(22-14)24-16-10-5-11-17(23-16)26-2/h3-11H,1-2H3,(H,22,23,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021684
(CHEMBL3298191)Show SMILES COc1cc(Nc2nc3cccc(-c4ccccc4-c4cn[nH]c4)c3o2)cc(OC)c1OC Show InChI InChI=1S/C25H22N4O4/c1-30-21-11-16(12-22(31-2)24(21)32-3)28-25-29-20-10-6-9-19(23(20)33-25)18-8-5-4-7-17(18)15-13-26-27-14-15/h4-14H,1-3H3,(H,26,27)(H,28,29) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021680
(CHEMBL3297946)Show SMILES COc1ccc(Nc2nc3cccc(-c4c(F)cccc4OC)c3o2)cc1 |(11.58,-23.5,;13.13,-23.5,;13.9,-22.16,;13.13,-20.83,;13.9,-19.49,;15.44,-19.5,;16.21,-18.17,;17.75,-18.17,;18.66,-16.92,;20.13,-17.4,;21.45,-16.62,;22.79,-17.39,;22.8,-18.94,;21.46,-19.72,;21.47,-21.26,;20.13,-22.03,;18.8,-21.25,;20.13,-23.57,;21.47,-24.34,;22.81,-23.56,;22.8,-22.02,;24.13,-21.25,;25.47,-22.01,;20.12,-18.94,;18.66,-19.41,;16.21,-20.83,;15.45,-22.16,)| Show InChI InChI=1S/C21H17FN2O3/c1-25-14-11-9-13(10-12-14)23-21-24-17-7-3-5-15(20(17)27-21)19-16(22)6-4-8-18(19)26-2/h3-12H,1-2H3,(H,23,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |
Ribosomal protein S6 kinase alpha-3
(Homo sapiens (Human)) | BDBM50021669
(CHEMBL3297949)Show SMILES COc1cccc(F)c1-c1cccc2nc(Nc3cccc(c3)S(N)(=O)=O)oc12 |(25.47,-22.01,;24.13,-21.25,;22.8,-22.02,;22.81,-23.56,;21.47,-24.34,;20.13,-23.57,;20.13,-22.03,;18.8,-21.25,;21.47,-21.26,;21.46,-19.72,;22.8,-18.94,;22.79,-17.39,;21.45,-16.62,;20.13,-17.4,;18.66,-16.92,;17.75,-18.17,;16.21,-18.17,;15.44,-19.5,;16.21,-20.83,;15.45,-22.16,;13.9,-22.16,;13.13,-20.83,;13.9,-19.49,;11.59,-20.82,;10.82,-19.49,;11.98,-22.31,;10.24,-21.58,;18.66,-19.41,;20.12,-18.94,)| Show InChI InChI=1S/C20H16FN3O4S/c1-27-17-10-4-8-15(21)18(17)14-7-3-9-16-19(14)28-20(24-16)23-12-5-2-6-13(11-12)29(22,25)26/h2-11H,1H3,(H,23,24)(H2,22,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for Biomedical Research
Curated by ChEMBL
| Assay Description Inhibition of RSK2 in mouse BAF cells assessed as YB1 phosphorylation at Ser102 by electrochemiluminescence assay |
Bioorg Med Chem Lett 24: 1592-6 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.058 BindingDB Entry DOI: 10.7270/Q2V126DB |
More data for this Ligand-Target Pair | |