BDBM50394802 TAGITININ A

SMILES CC(C)C(=O)O[C@@H]1C[C@@]2(C)O[C@](O)(C[C@@H]2O)[C@@H](C)C[C@H]2OC(=O)C(=C)[C@H]12

InChI Key InChIKey=HREHFPZHVCNOMQ-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 = 50394802   

TargetPeroxisome proliferator-activated receptor gamma(Human)
National Kaohsiung Normal University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50394802BDBM50394802(TAGITININ A)
Affinity DataIC50: 5.50E+4nMAssay Description:Inhibition of fluormone binding to human PPARgamma LBD after 2 hrs by competitive fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetDihydroorotate dehydrogenase (fumarate)(Leishmania major)
University of S£O Paulo

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50394802BDBM50394802(TAGITININ A)
Affinity DataIC50: 7.94E+5nMAssay Description:Inhibition of recombinant oligo-histidine-tagged Leishmania major DHODH expressed in Escherichia coli BL21(DE3) cells using DHO as substrate measured...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetDihydroorotate dehydrogenase (fumarate)(Leishmania major)
University of S£O Paulo

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50394802BDBM50394802(TAGITININ A)
Affinity DataIC50: 7.96E+5nMAssay Description:Inhibition of recombinant oligo-histidine-tagged Leishmania major DHODH expressed in Escherichia coli BL21(DE3) cells using DHO as substrate measured...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed