BDBM103302 SCH772984::US8546404, 6
SMILES: O=C(CN1CC[C@@H](C1)C(=O)Nc1ccc2[nH]nc(-c3ccncc3)c2c1)N1CCN(CC1)c1ccc(cc1)-c1ncccn1
InChI Key: InChIKey=HDAJDNHIBCDLQF-RUZDIDTESA-N
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 (Mus musculus (Mouse)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | US Patent | n/a | n/a | 0.800 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Sharp & Dohme US Patent | Assay Description Activated ERK2 activity was determined in the IMAP assay format. | US Patent US8546404 (2013) BindingDB Entry DOI: 10.7270/Q2959G61 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 1 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 300 | n/a | n/a | n/a | 7.5 | 30 |
George Washington University | Assay Description For ERK1 and ERK2, the buffer contained 20 mM HEPES (pH 7.5), 150 mM NaCl and 0.5 mM TCEP. For haspin, the buffer contained 20 mM HEPES (pH 7.5), 250... | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 1 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 10 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 632 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
c-Jun N-terminal kinase 1 truncation (JNK1) (aa 1-363) (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serine/threonine-protein kinase 17A (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 114 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 9 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 783 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dual specificity mitogen-activated protein kinase kinase 3 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 304 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serine/threonine-protein kinase Aurora-C (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 580 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Casein kinase II alpha' (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dual specificity protein kinase CLK2 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 104 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dual specificty protein kinase CLK1 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 508 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Haspin (aa 465-798) (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dual specificity protein kinase TTK (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 193 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Misshapen-like kinase 1 (MINK) (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 942 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase kinase kinase kinase 4 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 503 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serine/threonine-protein kinase D1 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 535 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 3 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 213 | n/a | n/a | n/a | 7.5 | 15 |
George Washington University | Assay Description For ERK1 and ERK2, the buffer contained 20 mM HEPES (pH 7.5), 150 mM NaCl and 0.5 mM TCEP. For haspin, the buffer contained 20 mM HEPES (pH 7.5), 250... | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 1 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 233 | n/a | n/a | n/a | 7.5 | 15 |
George Washington University | Assay Description For ERK1 and ERK2, the buffer contained 20 mM HEPES (pH 7.5), 150 mM NaCl and 0.5 mM TCEP. For haspin, the buffer contained 20 mM HEPES (pH 7.5), 250... | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Haspin (aa 465-798) (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 297 | n/a | n/a | n/a | 7.5 | 15 |
George Washington University | Assay Description For ERK1 and ERK2, the buffer contained 20 mM HEPES (pH 7.5), 150 mM NaCl and 0.5 mM TCEP. For haspin, the buffer contained 20 mM HEPES (pH 7.5), 250... | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 3 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 8.30 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University | Assay Description The IC50 values of selected kinases were determined using either Z'LYTE, Adapta or LanthaScreen assays. | Nat Chem Biol 10: 853-860 (2014) Article DOI: 10.1038/nchembio.1629 BindingDB Entry DOI: 10.7270/Q28G8JCH | |||||||||||
More data for this Ligand-Target Pair |
Cell (A) | Syringe (B) | Cell Links | Syringe Links | Cell + Syr Links | ΔG° kcal/mole | -TΔS° kcal/mole | ΔH° kcal/mole | log K | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|
MAP kinase ERK1 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | GoogleScholar PDB | PC cid PC sid | -8.78 | 11.8 | -20.6 | 6.66 | 7.5 | 15 | |
George Washington University | Nat Chem Biol 10: 853-860 (2014) | |||||||||
MAP kinase ERK2 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | DrugBank GoogleScholar KEGG PDB | PC cid PC sid | -8.70 | 12.4 | -21.1 | 6.60 | 7.5 | 15 | |
George Washington University | Nat Chem Biol 10: 853-860 (2014) | |||||||||
Haspin (465-798) (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | GoogleScholar PDB | PC cid PC sid | -8.66 | 8.95 | -17.6 | 6.57 | 7.5 | 15 | |
George Washington University | Nat Chem Biol 10: 853-860 (2014) | |||||||||
MAP kinase ERK2 (Homo sapiens (Human)) | BDBM103302 (SCH772984 | US8546404, 6) | DrugBank GoogleScholar KEGG PDB | PC cid PC sid | -9.08 | 21.5 | -30.6 | 6.55 | 7.5 | 30 | |
George Washington University | Nat Chem Biol 10: 853-860 (2014) |