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SMILES: COc1ccc(cc1)S(=O)(=O)N(C[C@@H](O)CN1[C@@H](Cc2ccccc2)COC1=O)CC1CCCC1

InChI Key: InChIKey=MJZRNKNFJITYEZ-XZOQPEGZSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50073367   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM50073367
PNG
(CHEMBL420158 | N-[(S)-3-((S)-4-Benzyl-2-oxo-oxazol...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(C[C@@H](O)CN1[C@@H](Cc2ccccc2)COC1=O)CC1CCCC1
Show InChI InChI=1S/C26H34N2O6S/c1-33-24-11-13-25(14-12-24)35(31,32)27(16-21-9-5-6-10-21)17-23(29)18-28-22(19-34-26(28)30)15-20-7-3-2-4-8-20/h2-4,7-8,11-14,21-23,29H,5-6,9-10,15-19H2,1H3/t22-,23+/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 1.50E+3n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Compound was assayed for inhibition against HIV protease activity

Bioorg Med Chem Lett 8: 3637-42 (1999)


BindingDB Entry DOI: 10.7270/Q2GM86FH
More data for this
Ligand-Target Pair