BDBM50331833 5-propylamido-2-sulfamoyl-1,3,4-thiadiazole::CHEMBL1288786
SMILES: CCC(=O)Nc1nnc(s1)S(N)(=O)=O
InChI Key: InChIKey=PCBBBQKRWNGNDW-UHFFFAOYSA-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 |
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Chitinase (chiA1) (Neosartorya fumigata (Aspergillus fumigatus)) | BDBM50331833 (5-propylamido-2-sulfamoyl-1,3,4-thiadiazole | CHEM...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 3.15E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee Curated by ChEMBL | Assay Description Inhibition of Aspergillus fumigatus ChiA1 expressed in Pichia pastoris after 70 mins | Bioorg Med Chem 18: 8334-40 (2010) Article DOI: 10.1016/j.bmc.2010.09.062 BindingDB Entry DOI: 10.7270/Q2NZ87WR | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (docked) |