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SMILES: O=C1OCc2cc(ccc12)-c1ccc(\C=C2\CCN(Cc3ccccc3)C2=O)s1

InChI Key: InChIKey=QGHCFFJQOWWHKM-AQTBWJFISA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50361438   
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))		BDBM50361438
PNG
(CHEMBL1934402)
Show SMILES O=C1OCc2cc(ccc12)-c1ccc(\C=C2\CCN(Cc3ccccc3)C2=O)s1 |w:13.15|
Show InChI InChI=1S/C24H19NO3S/c26-23-18(10-11-25(23)14-16-4-2-1-3-5-16)13-20-7-9-22(29-20)17-6-8-21-19(12-17)15-28-24(21)27/h1-9,12-13H,10-11,14-15H2/b18-13-
NCI pathway
KEGG

UniProtKB/SwissProt

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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-mediated lysis of Jurkat cells assessed as [51Cr] release preincubated with perforin for 30 mins followed by incub...

Bioorg Med Chem 20: 1319-36 (2012)


Article DOI: 10.1016/j.bmc.2011.12.011
BindingDB Entry DOI: 10.7270/Q29C6XW9
More data for this
Ligand-Target Pair