null

SMILES: O[C@H](C[C@@H](O)C(=O)NC1[C@H](O)Cc2ccccc12)[C@@H](Oc1ccccc1)C(=O)NC1[C@@H](O)Cc2ccccc12

InChI Key: InChIKey=FKMNQBOIFQLSQU-ZJNYEDAQSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50156148   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50156148 (3,5-Dihydroxy-2-phenoxy-hexanedioic acid bis-[(2-h...) Show SMILES O[C@H](C[C@@H](O)C(=O)NC1[C@H](O)Cc2ccccc12)[C@@H](Oc1ccccc1)C(=O)NC1[C@@H](O)Cc2ccccc12 Show InChI InChI=1S/C30H32N2O7/c33-22-14-17-8-4-6-12-20(17)26(22)31-29(37)25(36)16-24(35)28(39-19-10-2-1-3-11-19)30(38)32-27-21-13-7-5-9-18(21)15-23(27)34/h1-13,22-28,33-36H,14-16H2,(H,31,37)(H,32,38)/t22-,23+,24-,25-,26?,27?,28-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Inhibition constant for human immunodeficiency virus type 1 protease				J Med Chem 47: 5953-61 (2004) Article DOI: 10.1021/jm0499110 BindingDB Entry DOI: 10.7270/Q2FQ9XDV
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50156148 (3,5-Dihydroxy-2-phenoxy-hexanedioic acid bis-[(2-h...) Show SMILES O[C@H](C[C@@H](O)C(=O)NC1[C@H](O)Cc2ccccc12)[C@@H](Oc1ccccc1)C(=O)NC1[C@@H](O)Cc2ccccc12 Show InChI InChI=1S/C30H32N2O7/c33-22-14-17-8-4-6-12-20(17)26(22)31-29(37)25(36)16-24(35)28(39-19-10-2-1-3-11-19)30(38)32-27-21-13-7-5-9-18(21)15-23(27)34/h1-13,22-28,33-36H,14-16H2,(H,31,37)(H,32,38)/t22-,23+,24-,25-,26?,27?,28-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	35.8	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity for human immunodeficiency virus type 1 protease				J Med Chem 47: 5953-61 (2004) Article DOI: 10.1021/jm0499110 BindingDB Entry DOI: 10.7270/Q2FQ9XDV
					More data for this Ligand-Target Pair