PDB ligand accession: TOP
DrugBank: DB00440
PubChem:
ChEMBL:
InChI Key: IEDVJHCEMCRBQM-UHFFFAOYSA-N
SMILES: COc1cc(cc(c1OC)OC)Cc2cnc(nc2N)N
Drug action: modulator
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: Anisoles
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3S3V | Download | Experimental | e3s3vA1 | Dihydrofolate reductases | LigPlot |
2W3A | Download | Experimental | e2w3aA1 e2w3aB1 | Dihydrofolate reductases Dihydrofolate reductases | LigPlot |
3N0H | Download | Experimental | e3n0hA1 | Dihydrofolate reductases | LigPlot |