BDBM50386180 CHEMBL2042792
SMILES: COc1cc(\C=C\C(=O)N\N=C\c2ccccc2O)cc(c1OC)[N+]([O-])=O
InChI Key: InChIKey=GTSXMUWLYJNPIP-FIQDDSDUSA-N
Data: 1 IC50
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cruzipain (Trypanosoma cruzi) | BDBM50386180 (CHEMBL2042792) | PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.39E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Tecnologia em F£rmacos - Farmanguinhos Curated by ChEMBL | Assay Description Inhibition of Trypanosoma cruzi C-terminally truncated cruzain expressed in Escherichia coli using Z-Phe-Arg-AMC as substrate incubated for 5 mins pr... | Eur J Med Chem 54: 512-21 (2012) Article DOI: 10.1016/j.ejmech.2012.05.041 BindingDB Entry DOI: 10.7270/Q2HM59HT | |||||||||||
More data for this Ligand-Target Pair |