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BDBM154601 US8999957, Column 155, Compound 1::US8999957, Table 1, Compound 18

SMILES: CN1CC(CC(C1)c1ccccc1)NC(=O)c1ccc2[nH]nc(-c3ccncc3)c2c1

InChI Key:

Data: 4 IC50 2 Kd

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 154601
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Extracellular signal-regulated kinase 1 (ERK1) (Mus musculus (Mouse))	BDBM154601 (US8999957, Column 155, Compound 1 \| US8999957, Tab...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description The SAR (Structure Activity Relationship) for ERK ligands covered by this invention was interrogated using the TdF (Temperature Dependence Fluorescen...				US Patent US8999957 (2015) BindingDB Entry DOI: 10.7270/Q2GB22S9
Merck Sharp & Dohme Corp. US Patent					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 1 (Mus musculus (Mouse))	BDBM154601 (US8999957, Column 155, Compound 1 \| US8999957, Tab...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7.40	n/a	n/a	n/a	n/a	7.2	25
Merck Sharp & Dohme Corp. US Patent					Assay Description Activity of compounds against inactive ERK2 was tested in a coupled MEK1/ERK2 IMAP assay as follows: Compounds were diluted to 25x final test concent...				US Patent US8999957 (2015) BindingDB Entry DOI: 10.7270/Q2GB22S9
Merck Sharp & Dohme Corp. US Patent					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 1 (Mus musculus (Mouse))	BDBM154601 (US8999957, Column 155, Compound 1 \| US8999957, Tab...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Condition 1: Activated ERK2 activity was also determined in the IMAP assay format using the procedure outlined above. 1 μl of 25� compound was a...				US Patent US8999957 (2015) BindingDB Entry DOI: 10.7270/Q2GB22S9
Merck Sharp & Dohme Corp. US Patent					More data for this Ligand-Target Pair
Extracellular signal-regulated kinase 1 (ERK1) (Mus musculus (Mouse))	BDBM154601 (US8999957, Column 155, Compound 1 \| US8999957, Tab...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description The SAR (Structure Activity Relationship) for ERK ligands covered by this invention was interrogated using the TdF (Temperature Dependence Fluorescen...				US Patent US8999957 (2015) BindingDB Entry DOI: 10.7270/Q2GB22S9
Merck Sharp & Dohme Corp. US Patent					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 1 (Mus musculus (Mouse))	BDBM154601 (US8999957, Column 155, Compound 1 \| US8999957, Tab...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7.40	n/a	n/a	n/a	n/a	7.2	25
Merck Sharp & Dohme Corp. US Patent					Assay Description Activity of compounds against inactive ERK2 was tested in a coupled MEK1/ERK2 IMAP assay as follows: Compounds were diluted to 25x final test concent...				US Patent US8999957 (2015) BindingDB Entry DOI: 10.7270/Q2GB22S9
Merck Sharp & Dohme Corp. US Patent					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 1 (Mus musculus (Mouse))	BDBM154601 (US8999957, Column 155, Compound 1 \| US8999957, Tab...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Condition 1: Activated ERK2 activity was also determined in the IMAP assay format using the procedure outlined above. 1 μl of 25� compound was a...				US Patent US8999957 (2015) BindingDB Entry DOI: 10.7270/Q2GB22S9
Merck Sharp & Dohme Corp. US Patent					More data for this Ligand-Target Pair