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BDBM50201885 3-(3-acetylsulfanyl-2-oxopropyl)indole-1-carboxylic acid benzyl ester::CHEMBL262739

SMILES: CC(=O)SCC(=O)Cc1cn(C(=O)OCc2ccccc2)c2ccccc12

InChI Key: InChIKey=KFKIPDJTXBQTHU-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50201885   
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
Peptide deformylase


(Escherichia coli)
BDBM50201885
PNG
(3-(3-acetylsulfanyl-2-oxopropyl)indole-1-carboxyli...)
Show SMILES CC(=O)SCC(=O)Cc1cn(C(=O)OCc2ccccc2)c2ccccc12
Show InChI InChI=1S/C21H19NO4S/c1-15(23)27-14-18(24)11-17-12-22(20-10-6-5-9-19(17)20)21(25)26-13-16-7-3-2-4-8-16/h2-10,12H,11,13-14H2,1H3
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.50E+5n/an/an/an/an/an/a



Centre National de la Recherche Scientifique

Curated by ChEMBL


Assay Description
Inhibition of PDF1B


J Med Chem 50: 10-20 (2007)


Article DOI: 10.1021/jm060910c
BindingDB Entry DOI: 10.7270/Q22Z16B7
More data for this
Ligand-Target Pair
Peptide deformylase 1A, chloroplastic


(Arabidopsis thaliana)
BDBM50201885
PNG
(3-(3-acetylsulfanyl-2-oxopropyl)indole-1-carboxyli...)
Show SMILES CC(=O)SCC(=O)Cc1cn(C(=O)OCc2ccccc2)c2ccccc12
Show InChI InChI=1S/C21H19NO4S/c1-15(23)27-14-18(24)11-17-12-22(20-10-6-5-9-19(17)20)21(25)26-13-16-7-3-2-4-8-16/h2-10,12H,11,13-14H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.00E+5n/an/an/an/an/an/a



Centre National de la Recherche Scientifique

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana mitochondrial PDF1A


J Med Chem 50: 10-20 (2007)


Article DOI: 10.1021/jm060910c
BindingDB Entry DOI: 10.7270/Q22Z16B7
More data for this
Ligand-Target Pair