BDBM50078294 (R)-2-Cyano-3,3-dimethyl-N-((R)-1-methyl-2-phenoxy-ethyl)-butyramide::CHEMBL40347
SMILES: C[C@H](COc1ccccc1)NC(=O)[C@@H](C#N)C(C)(C)C
InChI Key: InChIKey=RHFCYORLEUNWBK-TZMCWYRMSA-N
Data: 2 KI
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) | BDBM50078294 ((R)-2-Cyano-3,3-dimethyl-N-((R)-1-methyl-2-phenoxy...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.580 | 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 Inhibitory activity against scytalone dehydratase enzyme obtained from Magnaporthe grisea | Bioorg Med Chem Lett 9: 1607-12 (1999) BindingDB Entry DOI: 10.7270/Q2JH3KBD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Scytalone dehydratase (Magnaporthe grisea) | BDBM50078294 ((R)-2-Cyano-3,3-dimethyl-N-((R)-1-methyl-2-phenoxy...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.30 | 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 Inhibitory activity against scytalone dehydratase enzyme obtained from Magnaporthe grisea | Bioorg Med Chem Lett 9: 1607-12 (1999) BindingDB Entry DOI: 10.7270/Q2JH3KBD | |||||||||||
More data for this Ligand-Target Pair |