BDBM337296 (R)-methyl(7-oxo-6-(1-phenylethyl)-5,6,7,8-tetrahydro-1H-pyrazolo[4,3-g]quinazolin-3-yl)carbamate::US9745307, Example 33

SMILES: COC(=O)NC(=N)c1cc2CN([C@H](C)c3ccccc3)C(=O)Nc2cc1N

InChI Key: InChIKey=SXRRITDVSFXZOM-LLVKDONJSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 337296   

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))	BDBM337296 ((R)-methyl(7-oxo-6-(1-phenylethyl)-5,6,7,8-tetrahy...) Show SMILES COC(=O)NC(=N)c1cc2CN([C@H](C)c3ccccc3)C(=O)Nc2cc1N |r| Show InChI InChI=1S/C19H21N5O3/c1-11(12-6-4-3-5-7-12)24-10-13-8-14(17(21)23-19(26)27-2)15(20)9-16(13)22-18(24)25/h3-9,11H,10,20H2,1-2H3,(H,22,25)(H2,21,23,26)/t11-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.20	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Activated ERK2 activity was determined in an IMAP-FP assay (Molecular Devices). Using this assay format, the potency (IC50) of each compound was dete...				US Patent US9745307 (2017) BindingDB Entry DOI: 10.7270/Q28G8NTK
					More data for this Ligand-Target Pair