Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'HIV-1 protease' and Ligand = 'BDBM81677'   

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)	BDBM81677 (CARB-KB32) Show SMILES CNC(=O)CCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(C[C@@H](C)O)S(=O)(=O)c1cccc(OC)c1 |r| Show InChI InChI=1S/C25H35N3O7S/c1-18(29)16-28(36(33,34)21-11-7-10-20(15-21)35-3)17-23(30)22(14-19-8-5-4-6-9-19)27-25(32)13-12-24(31)26-2/h4-11,15,18,22-23,29-30H,12-14,16-17H2,1-3H3,(H,26,31)(H,27,32)/t18-,22+,23-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	760	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland					Assay Description Inhibition assay using HIV protease and Sulfonamide compounds.				Chem Biol Drug Des 69: 298-313 (2007) Article DOI: 10.1111/j.1747-0285.2007.00514.x BindingDB Entry DOI: 10.7270/Q2TQ6011
					More data for this Ligand-Target Pair
HIV-1 protease (Human immunodeficiency virus)	BDBM81677 (CARB-KB32) Show SMILES CNC(=O)CCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(C[C@@H](C)O)S(=O)(=O)c1cccc(OC)c1 |r| Show InChI InChI=1S/C25H35N3O7S/c1-18(29)16-28(36(33,34)21-11-7-10-20(15-21)35-3)17-23(30)22(14-19-8-5-4-6-9-19)27-25(32)13-12-24(31)26-2/h4-11,15,18,22-23,29-30H,12-14,16-17H2,1-3H3,(H,26,31)(H,27,32)/t18-,22+,23-/m1/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.17E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UMBI Curated by ChEMBL					Assay Description Inhibition of HIV1 protease Q7K mutant by FRET method				J Med Chem 52: 737-54 (2009) Article DOI: 10.1021/jm8009525 BindingDB Entry DOI: 10.7270/Q2PN98FX
					More data for this Ligand-Target Pair
HIV-1 protease (Human immunodeficiency virus)	BDBM81677 (CARB-KB32) Show SMILES CNC(=O)CCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(C[C@@H](C)O)S(=O)(=O)c1cccc(OC)c1 |r| Show InChI InChI=1S/C25H35N3O7S/c1-18(29)16-28(36(33,34)21-11-7-10-20(15-21)35-3)17-23(30)22(14-19-8-5-4-6-9-19)27-25(32)13-12-24(31)26-2/h4-11,15,18,22-23,29-30H,12-14,16-17H2,1-3H3,(H,26,31)(H,27,32)/t18-,22+,23-/m1/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.18E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UMBI Curated by ChEMBL					Assay Description Inhibition of HIV1 protease Q7K mutant by FRET method				J Med Chem 52: 737-54 (2009) Article DOI: 10.1021/jm8009525 BindingDB Entry DOI: 10.7270/Q2PN98FX
					More data for this Ligand-Target Pair