Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'HIV-1 protease' and Ligand = 'BDBM468560'   

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)	BDBM468560 (US10806794, Compound mPEG5-N-Darunavir) Show SMILES COCCOCCOCCOCCOCCNc1ccc(cc1)S(=O)(=O)N(CC(C)C)CC(O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12 |r| Show InChI InChI=1S/C38H59N3O12S/c1-29(2)26-41(27-35(42)34(25-30-7-5-4-6-8-30)40-38(43)53-36-28-52-37-33(36)13-15-51-37)54(44,45)32-11-9-31(10-12-32)39-14-16-47-19-20-49-23-24-50-22-21-48-18-17-46-3/h4-12,29,33-37,39,42H,13-28H2,1-3H3,(H,40,43)/t33-,34-,35?,36-,37+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Nektar Therapeutics US Patent					Assay Description Protease inhibitors (PI) are used to treat HIV infection by preventing viral assembly and maturation through the inhibition of HIV-1 protease activit...				US Patent US10806794 (2020) BindingDB Entry DOI: 10.7270/Q2QR516Q
					More data for this Ligand-Target Pair