Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM50113655'   

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))	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
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