PDB ligand accession: YIN
DrugBank: n/a
PubChem: 1874294;5594130;
ChEMBL:
InChI Key: HNNGTASVWGJHBY-XZOQPEGZSA-N
SMILES: c1ccc2c(c1)C3=C(C(N4C(=N3)NC=N4)c5ccc(cc5)Br)C(O2)c6ccc(cc6)Br
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Flavonoids
- Subclass: Flav-3-enes
- Class: Flavonoids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3JZK | Download | Experimental | e3jzkA1 | SWIB/MDM2 domain | LigPlot |