PDB ligand accession: ML1
DrugBank: DB01065
InChI Key: DRLFMBDRBRZALE-UHFFFAOYSA-N
SMILES: CC(=O)NCCc1c[nH]c2c1cc(cc2)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P27797 | Download | Predicted | P27797_F1_nD1 | jelly-roll |
3POS | Predicted | e3posA1 e3posB1 e3posC1 | ||
3POW | Predicted | e3powA1 | ||
5LK5 | Predicted | e5lk5A1 e5lk5B1 e5lk5C1 e5lk5D1 e5lk5E1 e5lk5F1 e5lk5G1 e5lk5H1 e5lk5I1 e5lk5J1 | ||
5V90 | Predicted | e5v90D1 e5v90B1 | ||
6ENY | Predicted | e6enyG2 e6enyG1 |