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 |
---|---|---|---|---|
P49761 | Download | Predicted | P49761_F1_nD1 | Protein kinase/SAICAR synthase/ATP-grasp |
2EU9 | Predicted | e2eu9A1 | ||
2EXE | Predicted | e2exeA1 | ||
2WU6 | Predicted | e2wu6A1 | ||
2WU7 | Predicted | e2wu7A1 | ||
3RAW | Predicted | e3rawA1 e3rawB1 | ||
6FT7 | Predicted | e6ft7A1 e6ft7B1 | ||
6FYP | Predicted | e6fypA1 | ||
6FYR | Predicted | e6fyrA1 | ||
6KHF | Predicted | e6khfA1 | ||
6RCT | Predicted | e6rctB1 e6rctA1 |