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SMILES: COc1ccc(cc1)-c1ccc(Cn2ccc(=S)c(O)c2C)cc1

InChI Key: InChIKey=UCDNZIDTIQVGNQ-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50485654   
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
Elastase


(Pseudomonas aeruginosa)		BDBM50485654
PNG
(CHEMBL2147000)
Show SMILES COc1ccc(cc1)-c1ccc(Cn2ccc(=S)c(O)c2C)cc1
Show InChI InChI=1S/C20H19NO2S/c1-14-20(22)19(24)11-12-21(14)13-15-3-5-16(6-4-15)17-7-9-18(23-2)10-8-17/h3-12,22H,13H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.58E+3n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at Pseudomonas aeruginosa LasB using Abz-Ala-Gly-Leu-Ala-p-Nitro-Benzyl-Amide as substrate incubated for 30 mins prior to substra...

ACS Med Chem Lett 3: 668-672 (2012)


Article DOI: 10.1021/ml300128f
BindingDB Entry DOI: 10.7270/Q2BG2RVM
More data for this
Ligand-Target Pair