BindingDB logo
myBDB logout

BDBM50480882 CHEMBL573279

SMILES: [H][C@]12C[C@@H](OP(=O)(SCCN)N(CCCl)CCCl)C=C[C@]11CCN(C)Cc3ccc(OC)c(O2)c13

InChI Key: InChIKey=ODFMTQKYSYZABQ-KQYVQNMBSA-N

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50480882   
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
Catalase


(Rattus norvegicus)
BDBM50480882
PNG
(CHEMBL573279)
Show SMILES [H][C@]12C[C@@H](OP(=O)(SCCN)N(CCCl)CCCl)C=C[C@]11CCN(C)Cc3ccc(OC)c(O2)c13 |r,c:18|
Show InChI InChI=1S/C23H34Cl2N3O4PS/c1-27-11-7-23-6-5-18(32-33(29,34-14-10-26)28(12-8-24)13-9-25)15-20(23)31-22-19(30-2)4-3-17(16-27)21(22)23/h3-6,18,20H,7-16,26H2,1-2H3/t18-,20-,23-,33?/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 2.70n/an/an/an/a



Sri Venkateswara University

Curated by ChEMBL


Assay Description
Inhibition of catalase in Wistar rat brain


Eur J Med Chem 45: 203-9 (2010)


Article DOI: 10.1016/j.ejmech.2009.09.045
BindingDB Entry DOI: 10.7270/Q2ZP48X4
More data for this
Ligand-Target Pair