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BDBM50498225 CHEMBL3577754

SMILES: [Br-].COc1ccc2c(c1)[nH]c1c(C)[n+](Cc3ccc(Cl)cc3)ccc21

InChI Key: InChIKey=HBULLRHIUADVRH-UHFFFAOYSA-O

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50498225   
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
Chitinase


(Onchocerca volvulus)		BDBM50498225
PNG
(CHEMBL3577754)
Show SMILES [Br-].COc1ccc2c(c1)[nH]c1c(C)[n+](Cc3ccc(Cl)cc3)ccc21
Show InChI InChI=1S/C20H17ClN2O/c1-13-20-18(17-8-7-16(24-2)11-19(17)22-20)9-10-23(13)12-14-3-5-15(21)6-4-14/h3-11H,12H2,1-2H3/p+1
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.49E+3n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of L3 larval stage of Onchocerca volvulus chitinase using 4-methylumbelliferyl-N-N'-N''-beta-chitotrioside as substrate assessed as releas...

ACS Med Chem Lett 6: 339-43 (2015)


Article DOI: 10.1021/ml500516r
BindingDB Entry DOI: 10.7270/Q2C53PTX
More data for this
Ligand-Target Pair