BDBM50528598 CHEMBL4474216

SMILES CSc1ccc(cc1)C(SCC(=O)NO)P(O)(O)=O

InChI Key InChIKey=HTOYGFWFDNRLAI-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50528598   

Target1-deoxy-D-xylulose 5-phosphate reductoisomerase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Heinrich Heine University D£Sseldorf

Curated by ChEMBL
LigandPNGBDBM50528598(CHEMBL4474216)
Affinity DataIC50: 100nMAssay Description:Inhibition of recombinant Mycobacterium tuberculosis IspC expressed in Escherichia coli M15 using 1-deoxy-D-xylulose 5-phosphate as substrate by phot...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/25/2021
Entry Details Article
PubMed
Target1-deoxy-D-xylulose 5-phosphate reductoisomerase, apicoplastic(Plasmodium falciparum (isolate 3D7))
Heinrich Heine University D£Sseldorf

Curated by ChEMBL
LigandPNGBDBM50528598(CHEMBL4474216)
Affinity DataIC50: 29nMAssay Description:Inhibition of recombinant Plasmodium falciparum IspC expressed in Escherichia coli using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/25/2021
Entry Details Article
PubMed
Target1-deoxy-D-xylulose 5-phosphate reductoisomerase(Escherichia coli (strain K12))
Heinrich Heine University D£Sseldorf

Curated by ChEMBL
LigandPNGBDBM50528598(CHEMBL4474216)
Affinity DataIC50: 22nMAssay Description:Inhibition of recombinant Escherichia coli IspC expressed in Escherichia coli M15 using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric as...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/25/2021
Entry Details Article
PubMed