null

SMILES: CN(C(Cc1ccccc1)C(O)=O)C(=O)[C@H](OCc1ccccc1)[C@H](O)[C@@H](O)[C@@H](OCc1ccccc1)C(=O)N(C)C(Cc1ccccc1)C(O)=O

InChI Key: InChIKey=JRMALWSMSWLAHG-MRFXAFHJSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50121517   

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)	BDBM50121517 (2-({2,5-Bis-benzyloxy-5-[(1-carboxy-2-phenyl-ethyl...) Show SMILES CN(C(Cc1ccccc1)C(O)=O)C(=O)[C@H](OCc1ccccc1)[C@H](O)[C@@H](O)[C@@H](OCc1ccccc1)C(=O)N(C)C(Cc1ccccc1)C(O)=O Show InChI InChI=1S/C40H44N2O10/c1-41(31(39(47)48)23-27-15-7-3-8-16-27)37(45)35(51-25-29-19-11-5-12-20-29)33(43)34(44)36(52-26-30-21-13-6-14-22-30)38(46)42(2)32(40(49)50)24-28-17-9-4-10-18-28/h3-22,31-36,43-44H,23-26H2,1-2H3,(H,47,48)(H,49,50)/t31?,32?,33-,34-,35-,36-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	140	n/a	n/a	7.03E+3	n/a	n/a	1.09E+5	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Association rate constant for the interaction between inhibitor and HIV-1 protease				J Med Chem 45: 5430-9 (2002) BindingDB Entry DOI: 10.7270/Q2GH9JP4
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50121517 (2-({2,5-Bis-benzyloxy-5-[(1-carboxy-2-phenyl-ethyl...) Show SMILES CN(C(Cc1ccccc1)C(O)=O)C(=O)[C@H](OCc1ccccc1)[C@H](O)[C@@H](O)[C@@H](OCc1ccccc1)C(=O)N(C)C(Cc1ccccc1)C(O)=O Show InChI InChI=1S/C40H44N2O10/c1-41(31(39(47)48)23-27-15-7-3-8-16-27)37(45)35(51-25-29-19-11-5-12-20-29)33(43)34(44)36(52-26-30-21-13-6-14-22-30)38(46)42(2)32(40(49)50)24-28-17-9-4-10-18-28/h3-22,31-36,43-44H,23-26H2,1-2H3,(H,47,48)(H,49,50)/t31?,32?,33-,34-,35-,36-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	n/a	0.938	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Association rate constant for the interaction between inhibitor and HIV-1 protease				J Med Chem 45: 5430-9 (2002) BindingDB Entry DOI: 10.7270/Q2GH9JP4
					More data for this Ligand-Target Pair