Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Transitional endoplasmic reticulum ATPase' and Ligand = 'BDBM478176'   

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))	BDBM478176 (US10894782, No 29 | US10894782, No 60 | US10894782...) Show SMILES CC(C)N1CCN(CCNC(=O)OCC#Cc2ccc(OCc3nnc(SC4CCCC=C4)n3-c3cccnc3)cc2C)CC1 |c:31| Show InChI InChI=1S/C34H43N7O3S/c1-26(2)40-20-18-39(19-21-40)17-16-36-34(42)43-22-8-9-28-13-14-30(23-27(28)3)44-25-32-37-38-33(45-31-11-5-4-6-12-31)41(32)29-10-7-15-35-24-29/h5,7,10-11,13-15,23-24,26,31H,4,6,12,16-22,25H2,1-3H3,(H,36,42)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	19	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
					More data for this Ligand-Target Pair
Transitional endoplasmic reticulum ATPase (Homo sapiens (Human))	BDBM478176 (US10894782, No 29 | US10894782, No 60 | US10894782...) Show SMILES CC(C)N1CCN(CCNC(=O)OCC#Cc2ccc(OCc3nnc(SC4CCCC=C4)n3-c3cccnc3)cc2C)CC1 |c:31| Show InChI InChI=1S/C34H43N7O3S/c1-26(2)40-20-18-39(19-21-40)17-16-36-34(42)43-22-8-9-28-13-14-30(23-27(28)3)44-25-32-37-38-33(45-31-11-5-4-6-12-31)41(32)29-10-7-15-35-24-29/h5,7,10-11,13-15,23-24,26,31H,4,6,12,16-22,25H2,1-3H3,(H,36,42)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	19	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
					More data for this Ligand-Target Pair
Transitional endoplasmic reticulum ATPase (Homo sapiens (Human))	BDBM478176 (US10894782, No 29 | US10894782, No 60 | US10894782...) Show SMILES CC(C)N1CCN(CCNC(=O)OCC#Cc2ccc(OCc3nnc(SC4CCCC=C4)n3-c3cccnc3)cc2C)CC1 |c:31| Show InChI InChI=1S/C34H43N7O3S/c1-26(2)40-20-18-39(19-21-40)17-16-36-34(42)43-22-8-9-28-13-14-30(23-27(28)3)44-25-32-37-38-33(45-31-11-5-4-6-12-31)41(32)29-10-7-15-35-24-29/h5,7,10-11,13-15,23-24,26,31H,4,6,12,16-22,25H2,1-3H3,(H,36,42)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	84	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
					More data for this Ligand-Target Pair