BindingDB logo
myBDB logout

null

SMILES: Nc1ccccc1-c1nnc(o1)C(=O)NC1CCCCC1

InChI Key: InChIKey=DAWXVAIHGJMRRA-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50295156   
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
Cruzipain


(Trypanosoma cruzi)		BDBM50295156
PNG
(5-(2-Amino-phenyl)-[1,3,4]oxadiazole-2-carboxylic ...)
Show SMILES Nc1ccccc1-c1nnc(o1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C15H18N4O2/c16-12-9-5-4-8-11(12)14-18-19-15(21-14)13(20)17-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7,16H2,(H,17,20)
PDB
MMDB

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 2.50E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of Trypanosoma cruzi cruzain preincubated for 5 mins before substrate addition

J Med Chem 52: 5005-8 (2010)


Article DOI: 10.1021/jm9009229
BindingDB Entry DOI: 10.7270/Q24J0F50
More data for this
Ligand-Target Pair