BDBM50528597 CHEMBL4592986
SMILES: COc1cc(OC)cc(c1)C(SCC(=O)N(C)O)P(O)(O)=O
InChI Key: InChIKey=RVEBSJDQWSFUER-UHFFFAOYSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50528597 (CHEMBL4592986) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 4.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Heinrich Heine University D£sseldorf Curated by ChEMBL | Assay Description Inhibition of recombinant Mycobacterium tuberculosis IspC expressed in Escherichia coli M15 using 1-deoxy-D-xylulose 5-phosphate as substrate by phot... | Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.058 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase, apicoplastic (Plasmodium falciparum (isolate 3D7)) | BDBM50528597 (CHEMBL4592986) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Heinrich Heine University D£sseldorf Curated by ChEMBL | Assay Description Inhibition of recombinant Plasmodium falciparum IspC expressed in Escherichia coli using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric a... | Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.058 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM50528597 (CHEMBL4592986) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
Heinrich Heine University D£sseldorf Curated by ChEMBL | Assay Description Inhibition of recombinant Escherichia coli IspC expressed in Escherichia coli M15 using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric as... | Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.058 | |||||||||||
More data for this Ligand-Target Pair |