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PubMed code 24929292

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
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)		BDBM50020696
PNG
(CHEMBL3291135)
Show SMILES Cc1c(\C=N\NC(=O)c2ccc(cc2)[N+]([O-])=O)no[n+]1[O-]
Show InChI InChI=1S/C11H9N5O5/c1-7-10(14-21-16(7)20)6-12-13-11(17)8-2-4-9(5-3-8)15(18)19/h2-6H,1H3,(H,13,17)/b12-6+
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.12E+4n/an/an/an/an/an/a



Universidade de S£o Paulo (USP)

Curated by ChEMBL


Assay Description
Inhibition of Trypanosoma cruzi cruzain expressed in Escherichia coli M15/DH5alpha using Z-Phe-Arg-AMC as substrate by spectrofluorometry

Eur J Med Chem 82: 418-25 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.077
BindingDB Entry DOI: 10.7270/Q2W37XVR
More data for this
Ligand-Target Pair
Cruzipain


(Trypanosoma cruzi)		BDBM50020697
PNG
(CHEMBL3291142)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)N\N=C\c1c(no[n+]1[O-])-c1ccccc1
Show InChI InChI=1S/C16H11N5O5/c22-16(12-6-8-13(9-7-12)20(23)24)18-17-10-14-15(19-26-21(14)25)11-4-2-1-3-5-11/h1-10H,(H,18,22)/b17-10+
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.51E+4n/an/an/an/an/an/a



Universidade de S£o Paulo (USP)

Curated by ChEMBL


Assay Description
Inhibition of Trypanosoma cruzi cruzain expressed in Escherichia coli M15/DH5alpha using Z-Phe-Arg-AMC as substrate by spectrofluorometry

Eur J Med Chem 82: 418-25 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.077
BindingDB Entry DOI: 10.7270/Q2W37XVR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%