Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'HIV-1 protease' and Ligand = 'BDBM468303'   

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)	BDBM468303 (US10806794, Compound di-mPEG6-Atazanavir) Show SMILES COCCOCCOCCOCCOCCOCCOC(=O)N[C@@H](C(=O)NC(Cc1ccccc1)[C@@H](O)CN(Cc1ccc(cc1)-c1ccccn1)NC(=O)[C@H](NC(=O)OCCOCCOCCOCCOCCOCCOC)C(C)(C)C)C(C)(C)C |r| Show InChI InChI=1S/C62H100N6O19/c1-61(2,3)55(65-59(72)86-44-42-84-40-38-82-36-34-80-32-30-78-28-26-76-24-22-74-7)57(70)64-53(46-49-14-10-9-11-15-49)54(69)48-68(47-50-17-19-51(20-18-50)52-16-12-13-21-63-52)67-58(71)56(62(4,5)6)66-60(73)87-45-43-85-41-39-83-37-35-81-33-31-79-29-27-77-25-23-75-8/h9-21,53-56,69H,22-48H2,1-8H3,(H,64,70)(H,65,72)(H,66,73)(H,67,71)/t53?,54-,55-,56-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	15.6	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
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