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 |
---|---|---|---|---|
P30291 | Download | Predicted | P30291_F1_nD1 | Protein kinase/SAICAR synthase/ATP-grasp |
1X8B | Predicted | e1x8bA2 | ||
2IN6 | Predicted | e2in6A2 | ||
2IO6 | Predicted | e2io6A2 | ||
2Z2W | Predicted | e2z2wA2 | ||
3BI6 | Predicted | e3bi6A2 | ||
3BIZ | Predicted | e3bizA2 | ||
3CQE | Predicted | e3cqeA2 | ||
3CR0 | Predicted | e3cr0A2 | ||
5V5Y | Predicted | e5v5yA1 | ||
5VC3 | Predicted | e5vc3A1 | ||
5VC4 | Predicted | e5vc4A1 | ||
5VC5 | Predicted | e5vc5A1 | ||
5VC6 | Predicted | e5vc6A1 | ||
5VD2 | Predicted | e5vd2A1 | ||
5VD4 | Predicted | e5vd4A1 | ||
5VD5 | Predicted | e5vd5A1 | ||
5VD7 | Predicted | e5vd7A1 | ||
5VD8 | Predicted | e5vd8A1 | ||
5VD9 | Predicted | e5vd9A1 | ||
5VDA | Predicted | e5vdaA1 |