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 |
---|---|---|---|---|
Q9NYY3 | Download | Predicted | Q9NYY3_F1_nD2 Q9NYY3_F1_nD1 Q9NYY3_F1_nD3 | RIP/Polo-box domain Protein kinase/SAICAR synthase/ATP-grasp RIP/Polo-box domain |
4I5M | Predicted | e4i5mA1 | ||
4I5P | Predicted | e4i5pA1 | ||
4I6B | Predicted | e4i6bA1 | ||
4I6F | Predicted | e4i6fA1 | ||
4I6H | Predicted | e4i6hA1 | ||
4RS6 | Predicted | e4rs6B2 e4rs6B1 e4rs6A2 e4rs6A1 | ||
4XB0 | Predicted | e4xb0A1 e4xb0B1 e4xb0A2 e4xb0B2 |