Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ATR-interacting protein/Serine/threonine-protein kinase ATR' and Ligand = 'BDBM414065'   

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
ATR-interacting protein/Serine/threonine-protein kinase ATR (Homo sapiens (Human))	BDBM414065 (US10421765, Example 53b) Show SMILES CS(=O)(=O)N1CCC(CC1)c1ncnc2C[C@H](C(F)F)N(Cc12)c1ccnc2[nH]ccc12 |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.42E+3	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System US Patent					Assay Description Human full-length FLAG-TEV-ATR and His6-ATRIP were co-expressed in HEK293 cells. The cell pellet (20 g) was harvested and lysed in 100 mL of lysis bu...				US Patent US10421765 (2019) BindingDB Entry DOI: 10.7270/Q2F47RHH
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