Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Transitional endoplasmic reticulum ATPase' and Ligand = 'BDBM163097'   

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))	BDBM163097 (US9062026, Table III, Compound 25) Show SMILES CNc1nc2ccccc2n1-c1nc(NCc2ccccc2)c2cccc(OC)c2n1 Show InChI InChI=1S/C24H22N6O/c1-25-23-27-18-12-6-7-13-19(18)30(23)24-28-21-17(11-8-14-20(21)31-2)22(29-24)26-15-16-9-4-3-5-10-16/h3-14H,15H2,1-2H3,(H,25,27)(H,26,28,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	233	n/a	n/a	n/a	n/a	n/a	n/a
Cleave Biosciences Inc. Curated by ChEMBL					Assay Description Inhibition of human p97 ATPase incubated for 15 mins by ADP Glo luminescence assay				J Med Chem 58: 9480-97 (2015) Article DOI: 10.1021/acs.jmedchem.5b01346 BindingDB Entry DOI: 10.7270/Q2KW5K2P
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Transitional endoplasmic reticulum ATPase (Homo sapiens (Human))	BDBM163097 (US9062026, Table III, Compound 25) Show SMILES CNc1nc2ccccc2n1-c1nc(NCc2ccccc2)c2cccc(OC)c2n1 Show InChI InChI=1S/C24H22N6O/c1-25-23-27-18-12-6-7-13-19(18)30(23)24-28-21-17(11-8-14-20(21)31-2)22(29-24)26-15-16-9-4-3-5-10-16/h3-14H,15H2,1-2H3,(H,25,27)(H,26,28,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<2.00E+3	n/a	n/a	n/a	n/a	7.5	37
Cleave Biosciences, Inc. US Patent					Assay Description The ATPase assay is performed according the following protocol: Purified enzyme (20 nM p97), substrate (20 uM ATP) and a dose titration of compounds ...				US Patent US9062026 (2015) BindingDB Entry DOI: 10.7270/Q2765D32
					More data for this Ligand-Target Pair