Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Transitional endoplasmic reticulum ATPase' and Ligand = 'BDBM478179'   

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
Transitional endoplasmic reticulum ATPase (Homo sapiens (Human))	BDBM478179 (US10894782, No 32) Show SMILES CC(C)N1CCCN(CCNC(=O)OCC#Cc2ccc(OCc3nnc(SC4CCCC4)n3-c3cccnc3)cc2C)CC1 Show InChI InChI=1S/C34H45N7O3S/c1-26(2)40-18-8-17-39(20-21-40)19-16-36-34(42)43-22-7-9-28-13-14-30(23-27(28)3)44-25-32-37-38-33(45-31-11-4-5-12-31)41(32)29-10-6-15-35-24-29/h6,10,13-15,23-24,26,31H,4-5,8,11-12,16-22,25H2,1-3H3,(H,36,42)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
University of Pittsburgh—Of the Commonwealth System of Higher Education US Patent					Assay Description Biomol Green (Enzo) is a bioluminescent, homogeneous assay that measures ADP formed from a biochemical reaction. Because of its high sensitivity, the...				US Patent US10894782 (2021) BindingDB Entry DOI: 10.7270/Q2TH8QTQ
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