BindingDB logo
myBDB logout

BDBM50031100 CHEMBL3337981

SMILES: NC(=O)c1cc([nH]n1)-c1ccccc1Cl

InChI Key: InChIKey=SOHQOPJBCOZHKH-UHFFFAOYSA-N

Data: 1 IC50

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 = 50031100   
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
Group X secretory phospholipase A2


(Homo sapiens (Human))
BDBM50031100
PNG
(CHEMBL3337981)
Show SMILES NC(=O)c1cc([nH]n1)-c1ccccc1Cl
Show InChI InChI=1S/C10H8ClN3O/c11-7-4-2-1-3-6(7)8-5-9(10(12)15)14-13-8/h1-5H,(H2,12,15)(H,13,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.33E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human sPLA2X using 1,2-bis(heptanoylthio) glycerophosphocholine substrate incubated for 30 mins


Bioorg Med Chem Lett 24: 5251-5 (2014)


Article DOI: 10.1016/j.bmcl.2014.09.058
BindingDB Entry DOI: 10.7270/Q2668FS8
More data for this
Ligand-Target Pair