PDB ligand accession: 2RC
DrugBank: DB12010
InChI Key: GKDRMWXFWHEQQT-UHFFFAOYSA-N
SMILES: CC1(C(=O)N(c2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)COP(=O)(O)O)C
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Aniline and substituted anilines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
Q7KZI7 | Download | Predicted | Q7KZI7_F1_nD2 Q7KZI7_F1_nD1 | TBP-like Protein kinase/SAICAR synthase/ATP-grasp |
3IEC | Predicted | e3iecC1 e3iecA1 e3iecB1 e3iecD2 e3iecC2 e3iecA2 e3iecB2 e3iecD1 | ||
5EAK | Predicted | e5eakA1 e5eakB1 e5eakA2 e5eakB2 | ||
5KZ7 | Predicted | e5kz7A1 e5kz7B2 e5kz7A2 e5kz7B1 | ||
5KZ8 | Predicted | e5kz8A2 e5kz8B1 e5kz8A1 e5kz8B2 |