BDBM50148785 ((R)-2-Acetoxy-3-phosphonooxy-propane-1-sulfinyl)-acetic acid::CHEMBL116916
SMILES: CC(=O)O[C@H](COP(O)(O)=O)CS(=O)CC(O)=O
InChI Key: InChIKey=UGYDFHXSRVOOLR-JRJSLVRASA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
6-phosphogluconate dehydrogenase (6PGD) (Homo sapiens (Human)) | BDBM50148785 (((R)-2-Acetoxy-3-phosphonooxy-propane-1-sulfinyl)-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cardiff University Curated by ChEMBL | Assay Description Inhibition constant against 6-phosphogluconate dehydrogenase of Trypanosoma brucei expressed in Escherichia coli | J Med Chem 47: 3427-37 (2004) Article DOI: 10.1021/jm031066i BindingDB Entry DOI: 10.7270/Q2S1837H | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
6-phosphogluconate dehydrogenase (6PGD) (Homo sapiens (Human)) | BDBM50148785 (((R)-2-Acetoxy-3-phosphonooxy-propane-1-sulfinyl)-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 6.25E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cardiff University Curated by ChEMBL | Assay Description Inhibition constant against 6-phosphogluconate dehydrogenase of sheep liver | J Med Chem 47: 3427-37 (2004) Article DOI: 10.1021/jm031066i BindingDB Entry DOI: 10.7270/Q2S1837H | |||||||||||
More data for this Ligand-Target Pair |