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BDBM50137224 CHEMBL3754272

SMILES: Oc1ccc(cc1)-c1ccc(s1)-c1ccc2C(=O)OCc2c1

InChI Key: InChIKey=CKXJZQNGRVBGAP-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 = 50137224   
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
Perforin-1


(Homo sapiens (Human))
BDBM50137224
PNG
(CHEMBL3754272)
Show SMILES Oc1ccc(cc1)-c1ccc(s1)-c1ccc2C(=O)OCc2c1
Show InChI InChI=1S/C18H12O3S/c19-14-4-1-11(2-5-14)16-7-8-17(22-16)12-3-6-15-13(9-12)10-21-18(15)20/h1-9,19H,10H2
NCI pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of recombinant perforin (unknown origin) mediated lysis of human Jurkat cells pre-incubated for 30 mins with perforin followed by incubati...


Bioorg Med Chem Lett 26: 355-60 (2016)


Article DOI: 10.1016/j.bmcl.2015.12.003
BindingDB Entry DOI: 10.7270/Q2B859ZN
More data for this
Ligand-Target Pair