BDBM50088972 2-[2-(4-Amino-4-carboxy-butyrylamino)-2-(carboxymethyl-carbamoyl)-ethylsulfanyl]-succinic acid dimethyl ester::CHEMBL174379
SMILES: COC(=O)CC(SCC(NC(=O)CCC(N)C(O)=O)C(=O)NCC(O)=O)C(=O)OC
InChI Key: InChIKey=HROUCKBOKAXXIU-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Glutathione transferase (GST) (Homo sapiens (Human)) | BDBM50088972 (2-[2-(4-Amino-4-carboxy-butyrylamino)-2-(carboxyme...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 2.08E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Wales Curated by ChEMBL | Assay Description Inhibitory activity against human Glutathione S-transferase P | Bioorg Med Chem Lett 10: 979-81 (2000) BindingDB Entry DOI: 10.7270/Q2BZ6589 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Glutathione S-transferase A2 (Homo sapiens (Human)) | BDBM50088972 (2-[2-(4-Amino-4-carboxy-butyrylamino)-2-(carboxyme...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | >2.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Wales Curated by ChEMBL | Assay Description The compound was tested for it's inhibitory activity against Onchocerca volvulus Glutathione S-transferase 2 | Bioorg Med Chem Lett 10: 979-81 (2000) BindingDB Entry DOI: 10.7270/Q2BZ6589 | |||||||||||
More data for this Ligand-Target Pair |