BDBM50646874 AJUGANIPPONIN B

SMILES C/C=C(\C)C(=O)O[C@@H](C[C@@]1(C)[C@H](C)C[C@H](OC(C)=O)[C@]2(COC(C)=O)[C@@H]1CCC[C@]21CO1)C1=CC(=O)OC1

InChI Key InChIKey=CHIBTOSDROCERR-UHFFFAOYSA-N

Data  1 IC50  2 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50646874   

TargetPeroxisome proliferator-activated receptor gamma(Human)
Sun Yat-sen University

Curated by ChEMBL
LigandPNGBDBM50646874(AJUGANIPPONIN B)
Affinity DataIC50: 6.99E+3nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetPeroxisome proliferator-activated receptor gamma(Human)
Sun Yat-sen University

Curated by ChEMBL
LigandPNGBDBM50646874(AJUGANIPPONIN B)
Affinity DataKd:  1.60E+4nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetPeroxisome proliferator-activated receptor gamma(Human)
Sun Yat-sen University

Curated by ChEMBL
LigandPNGBDBM50646874(AJUGANIPPONIN B)
Affinity DataKd:  1.27E+5nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed