Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Eukaryotic translation initiation factor 2-alpha kinase 3' and Ligand = 'BDBM102180'   

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
Eukaryotic translation initiation factor 2-alpha kinase 3 (Homo sapiens (Human))	BDBM102180 (US9695165, 12) Show SMILES CCn1c2cc(ncc2cc(-c2cc(OC)cc(OC)c2Cl)c1=O)-c1cc(NC(=O)C=C)ccc1F Show InChI InChI=1S/C27H23ClFN3O4/c1-5-25(33)31-16-7-8-21(29)20(10-16)22-13-23-15(14-30-22)9-19(27(34)32(23)6-2)18-11-17(35-3)12-24(36-4)26(18)28/h5,7-14H,1,6H2,2-4H3,(H,31,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
BLUEPRINT MEDICINES CORPORATION US Patent					Assay Description MDA-MB453 cells were plated in 96-well cell culture plates at a density of 1x105 cells. Cells were allowed to attach, and growth media was replaced w...				US Patent US9695165 (2017) BindingDB Entry DOI: 10.7270/Q25M67QZ
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