Found 16 hits of Enzyme Inhibition Constant Data 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 |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113657
(CHEMBL3604851)Show SMILES Brc1cccc(Cn2ccc(cc2=O)N2CCc3[nH]nc(c3C2)-c2ccncc2)c1 Show InChI InChI=1S/C23H20BrN5O/c24-18-3-1-2-16(12-18)14-29-10-6-19(13-22(29)30)28-11-7-21-20(15-28)23(27-26-21)17-4-8-25-9-5-17/h1-6,8-10,12-13H,7,11,14-15H2,(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 | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113658
(CHEMBL3604850)Show SMILES Clc1cccc(Cn2ccc(cc2=O)N2CCc3[nH]nc(c3C2)-c2ccncc2)c1 Show InChI InChI=1S/C23H20ClN5O/c24-18-3-1-2-16(12-18)14-29-10-6-19(13-22(29)30)28-11-7-21-20(15-28)23(27-26-21)17-4-8-25-9-5-17/h1-6,8-10,12-13H,7,11,14-15H2,(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 | 0.300 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113656
(CHEMBL3604852)Show SMILES CS(=O)(=O)c1cccc(Cn2ccc(cc2=O)N2CCc3[nH]nc(c3C2)-c2ccncc2)c1 Show InChI InChI=1S/C24H23N5O3S/c1-33(31,32)20-4-2-3-17(13-20)15-29-11-7-19(14-23(29)30)28-12-8-22-21(16-28)24(27-26-22)18-5-9-25-10-6-18/h2-7,9-11,13-14H,8,12,15-16H2,1H3,(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 | 0.400 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113659
(CHEMBL3604849)Show SMILES Fc1cccc(Cn2ccc(cc2=O)N2CCc3[nH]nc(c3C2)-c2ccncc2)c1 Show InChI InChI=1S/C23H20FN5O/c24-18-3-1-2-16(12-18)14-29-10-6-19(13-22(29)30)28-11-7-21-20(15-28)23(27-26-21)17-4-8-25-9-5-17/h1-6,8-10,12-13H,7,11,14-15H2,(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 | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113655
(CHEMBL3604853)Show SMILES Cc1cccc(Cn2ccc(cc2=O)N2CCc3[nH]nc(c3C2)-c2ccncc2)c1 Show InChI InChI=1S/C24H23N5O/c1-17-3-2-4-18(13-17)15-29-11-7-20(14-23(29)30)28-12-8-22-21(16-28)24(27-26-22)19-5-9-25-10-6-19/h2-7,9-11,13-14H,8,12,15-16H2,1H3,(H,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113654
(CHEMBL3604854)Show SMILES Fc1ccc(Cn2ccc(cc2=O)N2CCc3[nH]nc(c3C2)-c2ccncc2)cc1 Show InChI InChI=1S/C23H20FN5O/c24-18-3-1-16(2-4-18)14-29-11-7-19(13-22(29)30)28-12-8-21-20(15-28)23(27-26-21)17-5-9-25-10-6-17/h1-7,9-11,13H,8,12,14-15H2,(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 | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113661
(CHEMBL3604847)Show SMILES O=c1cc(ccn1Cc1ccccc1)N1CCc2[nH]nc(c2C1)-c1ccncc1 Show InChI InChI=1S/C23H21N5O/c29-22-14-19(8-12-28(22)15-17-4-2-1-3-5-17)27-13-9-21-20(16-27)23(26-25-21)18-6-10-24-11-7-18/h1-8,10-12,14H,9,13,15-16H2,(H,25,26) | 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 | 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 ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113653
(CHEMBL3604855)Show SMILES Brc1ccccc1Cn1ccc(cc1=O)N1CCc2[nH]nc(c2C1)-c1ccncc1 Show InChI InChI=1S/C23H20BrN5O/c24-20-4-2-1-3-17(20)14-29-11-7-18(13-22(29)30)28-12-8-21-19(15-28)23(27-26-21)16-5-9-25-10-6-16/h1-7,9-11,13H,8,12,14-15H2,(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 | 4.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113652
(CHEMBL3604856)Show InChI InChI=1S/C16H15N5O/c22-15-9-12(3-7-18-15)21-8-4-14-13(10-21)16(20-19-14)11-1-5-17-6-2-11/h1-3,5-7,9H,4,8,10H2,(H,18,22)(H,19,20) | PDB MMDB
NCI pathway 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 | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113672
(CHEMBL3604846)Show SMILES Cn1cc(ccc1=O)-c1n[nH]c2CCN(Cc12)c1ccn(Cc2ccccc2)c(=O)c1 Show InChI InChI=1S/C24H23N5O2/c1-27-15-18(7-8-22(27)30)24-20-16-28(12-10-21(20)25-26-24)19-9-11-29(23(31)13-19)14-17-5-3-2-4-6-17/h2-9,11,13,15H,10,12,14,16H2,1H3,(H,25,26) | 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 | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113761
(CHEMBL3604844)Show SMILES Fc1ccc(cc1)-c1n[nH]c2CCN(Cc12)c1ccn(Cc2ccccc2)c(=O)c1 Show InChI InChI=1S/C24H21FN4O/c25-19-8-6-18(7-9-19)24-21-16-28(13-11-22(21)26-27-24)20-10-12-29(23(30)14-20)15-17-4-2-1-3-5-17/h1-10,12,14H,11,13,15-16H2,(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 | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113660
(CHEMBL3604848)Show SMILES O=c1cc(ccn1Cc1ccccc1)N1CCc2[nH]nc(c2C1)-c1cccnc1 Show InChI InChI=1S/C23H21N5O/c29-22-13-19(8-11-28(22)15-17-5-2-1-3-6-17)27-12-9-21-20(16-27)23(26-25-21)18-7-4-10-24-14-18/h1-8,10-11,13-14H,9,12,15-16H2,(H,25,26) | 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 | 76 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113820
(CHEMBL3604843)Show InChI InChI=1S/C17H15FN4/c18-13-6-4-12(5-7-13)17-14-11-22(10-8-15(14)20-21-17)16-3-1-2-9-19-16/h1-7,9H,8,10-11H2,(H,20,21) | 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 | 89 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113677
(CHEMBL3604845)Show SMILES O=c1nccc([nH]1)-c1n[nH]c2CCN(Cc12)c1ccn(Cc2ccccc2)c(=O)c1 Show InChI InChI=1S/C22H20N6O2/c29-20-12-16(7-10-28(20)13-15-4-2-1-3-5-15)27-11-8-18-17(14-27)21(26-25-18)19-6-9-23-22(30)24-19/h1-7,9-10,12H,8,11,13-14H2,(H,25,26)(H,23,24,30) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113827
(CHEMBL3604842)Show InChI InChI=1S/C14H14FN3O/c1-9(19)18-7-6-13-12(8-18)14(17-16-13)10-2-4-11(15)5-3-10/h2-5H,6-8H2,1H3,(H,16,17) | PDB MMDB
NCI pathway 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 | 984 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description Inhibition of ERK2 (unknown origin) |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50113652
(CHEMBL3604856)Show InChI InChI=1S/C16H15N5O/c22-15-9-12(3-7-18-15)21-8-4-14-13(10-21)16(20-19-14)11-1-5-17-6-2-11/h1-3,5-7,9H,4,8,10H2,(H,18,22)(H,19,20) | PDB MMDB
NCI pathway 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 | >1.00E+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 ERK2 in human A375 cells assessed as phosphorylated of FRA level by Western analysis |
Bioorg Med Chem Lett 25: 3626-9 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.063 BindingDB Entry DOI: 10.7270/Q2QR4ZXX |
More data for this Ligand-Target Pair | |