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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cruzipain' and Ligand = 'BDBM50421532'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Cruzipain


(Trypanosoma cruzi)		BDBM50421532
PNG
(CHEMBL40503)
Show SMILES Brc1csc(\C=N\NC(=O)c2cnc3ccccc3c2)c1
Show InChI InChI=1S/C15H10BrN3OS/c16-12-6-13(21-9-12)8-18-19-15(20)11-5-10-3-1-2-4-14(10)17-7-11/h1-9H,(H,19,20)/b18-8+
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 3.02E+4n/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Inhibition of cruzain, the major cysteine protease from Trypanosoma cruzi

Bioorg Med Chem Lett 12: 1537-41 (2002)

Checked by Author
BindingDB Entry DOI: 10.7270/Q2W37XGT
More data for this
Ligand-Target Pair