BDBM50462020 CHEMBL515513
SMILES: ClC1=C(Nc2cccc(Cl)c2)C(=O)c2[nH]c(nc2C1=O)-c1ccncc1
InChI Key: InChIKey=MWCLNRRRGRPIQH-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3C-like proteinase (CVB3 3Cpro) (Coxsackievirus B3 (strain Nancy)) | BDBM50462020 (CHEMBL515513) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
Korea Research Institute of Chemical Technology Curated by ChEMBL | Assay Description Inhibition of human coxsackievirus B3 protease 3C expressed in Escherichia coli (BL21) using fluorogenic-Dabcyl-KEALFQGPPQFE-Edans as substrate after... | Bioorg Med Chem Lett 28: 2533-2538 (2018) Article DOI: 10.1016/j.bmcl.2018.05.046 BindingDB Entry DOI: 10.7270/Q2HT2S0T | |||||||||||
More data for this Ligand-Target Pair |