Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'HIV-1 protease' and Ligand = 'BDBM275785'   

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
HIV-1 protease (Human immunodeficiency virus)	BDBM275785 (US10071110, Compound 1-O-octadecylpropanediol-2-CD...) Show SMILES CCCCCCCCCCCCCCCCOCC(CO)OP(O)(=O)COC(CO)Cn1ccc(N)nc1=O Show InChI InChI=1S/C27H52N3O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-36-22-25(21-32)38-39(34,35)23-37-24(20-31)19-30-17-16-26(28)29-27(30)33/h16-17,24-25,31-32H,2-15,18-23H2,1H3,(H,34,35)(H2,28,29,33)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a
The Regents of the University of California US Patent					Assay Description Subconfluent MRC-5 cells in 24-well culture dishes were inoculated by removing the medium and adding HSV-1 virus at a dilution that will result in a ...				US Patent US10071110 (2018) BindingDB Entry DOI: 10.7270/Q2NS0WX9
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