null
SMILES: CCC(C#N)C(=O)N[C@H](C)[C@@H](Oc1cc(Cl)ccc1C#N)c1ccccc1
InChI Key: InChIKey=NIECKCGTAOLGLB-GMOTXPODSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Scytalone dehydratase (Magnaporthe grisea) | BDBM50078302 (CHEMBL417897 | N-[(1R,2S)-2-(5-Chloro-2-cyano-phen...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.0310 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Stine-Haskell Research Center Curated by ChEMBL | Assay Description Inhibition of scytalone dehydratase purified from Magnaporthe grisea | Bioorg Med Chem Lett 9: 1613-8 (1999) BindingDB Entry DOI: 10.7270/Q2DR2TN4 | |||||||||||
More data for this Ligand-Target Pair |