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 |
---|---|---|---|---|
Q9UKE5 | Download | Predicted | Q9UKE5_F1_nD2 Q9UKE5_F1_nD1 | Lag-3 N-terminal region Protein kinase/SAICAR synthase/ATP-grasp |
2X7F | Predicted | e2x7fA1 e2x7fB1 e2x7fC1 e2x7fE1 e2x7fD1 | ||
5AX9 | Predicted | e5ax9A1 e5ax9B1 e5ax9C1 | ||
5CWZ | Predicted | e5cwzA1 e5cwzB1 e5cwzC1 | ||
5D7A | Predicted | e5d7aA1 e5d7aC1 e5d7aB1 | ||
6RA7 | Predicted | e6ra7A1 |