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BDBM50128823 CHEBI:27750::E1504::ETHYL ACETATE::Ethyl acetate

SMILES: CCOC(C)=O

InChI Key: InChIKey=XEKOWRVHYACXOJ-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 6 PDB IDs match this monomer.

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50128823   
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
Cathepsin L1


(Homo sapiens (human))
BDBM50128823
PNG
(CHEBI:27750 | E1504 | ETHYL ACETATE | Ethyl acetat...)
Show SMILES CCOC(C)=O
Show InChI InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
PDB
MMDB

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Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Baylor University

Curated by ChEMBL


Assay Description
Inhibition of human liver cathepsin L using Z-FR-AMC as substrate measured every 15 sec for 5 mins by fluorescence assay


Bioorg Med Chem 23: 6974-92 (2015)


Article DOI: 10.1016/j.bmc.2015.09.036
BindingDB Entry DOI: 10.7270/Q2T43VX1
More data for this
Ligand-Target Pair