Found 4 hits for monomerid = 50030887 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/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)) | BDBM50030887
(CHEMBL3356120)Show SMILES Oc1ccc(NC(=O)[C@@H]2CCN(CC(=O)N3CCN(CC3)c3ccc(Br)cc3)C2)cc1Cl |r| Show InChI InChI=1S/C23H26BrClN4O3/c24-17-1-4-19(5-2-17)28-9-11-29(12-10-28)22(31)15-27-8-7-16(14-27)23(32)26-18-3-6-21(30)20(25)13-18/h1-6,13,16,30H,7-12,14-15H2,(H,26,32)/t16-/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of inactive ERK2 (unknown origin) coupled with human MEK1 using IMAP peptide substrate after 30 mins by coupled ERK2 assay |
J Med Chem 57: 8817-26 (2014)
Article DOI: 10.1021/jm500847m BindingDB Entry DOI: 10.7270/Q2Q52R6D |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50030887
(CHEMBL3356120)Show SMILES Oc1ccc(NC(=O)[C@@H]2CCN(CC(=O)N3CCN(CC3)c3ccc(Br)cc3)C2)cc1Cl |r| Show InChI InChI=1S/C23H26BrClN4O3/c24-17-1-4-19(5-2-17)28-9-11-29(12-10-28)22(31)15-27-8-7-16(14-27)23(32)26-18-3-6-21(30)20(25)13-18/h1-6,13,16,30H,7-12,14-15H2,(H,26,32)/t16-/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of phosphorylated ERK2 (unknown origin) by temperature dependent fluorescence (TdF) assay |
J Med Chem 57: 8817-26 (2014)
Article DOI: 10.1021/jm500847m BindingDB Entry DOI: 10.7270/Q2Q52R6D |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50030887
(CHEMBL3356120)Show SMILES Oc1ccc(NC(=O)[C@@H]2CCN(CC(=O)N3CCN(CC3)c3ccc(Br)cc3)C2)cc1Cl |r| Show InChI InChI=1S/C23H26BrClN4O3/c24-17-1-4-19(5-2-17)28-9-11-29(12-10-28)22(31)15-27-8-7-16(14-27)23(32)26-18-3-6-21(30)20(25)13-18/h1-6,13,16,30H,7-12,14-15H2,(H,26,32)/t16-/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 930 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of unphosphorylated ERK2 (unknown origin) by temperature dependent fluorescence (TdF) assay |
J Med Chem 57: 8817-26 (2014)
Article DOI: 10.1021/jm500847m BindingDB Entry DOI: 10.7270/Q2Q52R6D |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 1
(Homo sapiens (Human)) | BDBM50030887
(CHEMBL3356120)Show SMILES Oc1ccc(NC(=O)[C@@H]2CCN(CC(=O)N3CCN(CC3)c3ccc(Br)cc3)C2)cc1Cl |r| Show InChI InChI=1S/C23H26BrClN4O3/c24-17-1-4-19(5-2-17)28-9-11-29(12-10-28)22(31)15-27-8-7-16(14-27)23(32)26-18-3-6-21(30)20(25)13-18/h1-6,13,16,30H,7-12,14-15H2,(H,26,32)/t16-/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of activated ERK2 (unknown origin) using IMAP peptide substrate after 30 mins by activated ERK2 assay |
J Med Chem 57: 8817-26 (2014)
Article DOI: 10.1021/jm500847m BindingDB Entry DOI: 10.7270/Q2Q52R6D |
More data for this Ligand-Target Pair | |