Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dimer of Gag-Pol polyprotein [489-587]' and Ligand = 'BDBM1207'   

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
Dimer of Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM1207 (2-Aminobenzyl-Substituted AHPPA deriv. 24 | benzyl...) Show SMILES COc1ccc(CN[C@H]([C@H](O)[C@H](Cc2ccccc2)NC(=O)C(NC(=O)OCc2ccccc2)C(C)C)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)cc1 |r| Show InChI InChI=1S/C41H48N4O7/c1-26(2)35(45-41(50)52-25-29-14-8-5-9-15-29)39(48)43-33(22-27-12-6-4-7-13-27)38(47)37(42-24-28-18-20-31(51-3)21-19-28)40(49)44-36-32-17-11-10-16-30(32)23-34(36)46/h4-21,26,33-38,42,46-47H,22-25H2,1-3H3,(H,43,48)(H,44,49)(H,45,50)/t33-,34+,35?,36-,37+,38+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	8.10	-48.0	344	n/a	n/a	n/a	n/a	6.25	37
Sandoz Research Institute					Assay Description Enzymatic activity was measured by following cleavage of the substrate H-Lys-Ala-Arg-Val-Leu-pNph-Glu-Ala-Nle-NH2. Products of the cleavage reaction ...				J Med Chem 39: 2060-7 (1996) Article DOI: 10.1021/jm9508696 BindingDB Entry DOI: 10.7270/Q2VT1Q89
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