Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Transitional endoplasmic reticulum ATPase' and Ligand = 'BDBM478206'   

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))	BDBM478206 (US10894782, No 59) Show SMILES CN1CCN(CCNC(=O)OCC#Cc2ccc(OCc3nnc(SC4CCCC=C4)n3-c3cccnc3)cc2C)CC1 |c:29| Show InChI InChI=1S/C32H39N7O3S/c1-25-22-28(13-12-26(25)8-7-21-41-32(40)34-15-16-38-19-17-37(2)18-20-38)42-24-30-35-36-31(43-29-10-4-3-5-11-29)39(30)27-9-6-14-33-23-27/h4,6,9-10,12-14,22-23,29H,3,5,11,15-21,24H2,1-2H3,(H,34,40)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25	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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