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 |
---|---|---|---|---|
P51955 | Download | Predicted | P51955_F1_nD1 | Protein kinase/SAICAR synthase/ATP-grasp |
2JAV | Predicted | e2javA1 | ||
2W5A | Predicted | e2w5aA1 | ||
2W5B | Predicted | e2w5bA1 | ||
2W5H | Predicted | e2w5hA1 | ||
2WQO | Predicted | e2wqoA1 | ||
2XK3 | Predicted | e2xk3A1 | ||
2XK4 | Predicted | e2xk4A1 | ||
2XK6 | Predicted | e2xk6A1 | ||
2XK7 | Predicted | e2xk7A1 | ||
2XK8 | Predicted | e2xk8A1 | ||
2XKC | Predicted | e2xkcA1 | ||
2XKD | Predicted | e2xkdA1 | ||
2XKE | Predicted | e2xkeA1 | ||
2XKF | Predicted | e2xkfA1 | ||
2XNM | Predicted | e2xnmA1 | ||
2XNN | Predicted | e2xnnA1 | ||
2XNO | Predicted | e2xnoA1 | ||
2XNP | Predicted | e2xnpA1 | ||
4A4X | Predicted | e4a4xA1 | ||
4AFE | Predicted | e4afeA2 | ||
5M51 | Predicted | e5m51A1 | ||
5M53 | Predicted | e5m53A1 | ||
5M55 | Predicted | e5m55A1 | ||
5M57 | Predicted | e5m57A1 |