PDB ligand accession: 2K2
DrugBank: DB06595
InChI Key: BMGQWWVMWDBQGC-IIFHNQTCSA-N
SMILES: CC12C(C(CC(O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC
Drug action: antagonist
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Carbazoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P17252 | Download | Predicted | P17252_F1_nD4 P17252_F1_nD2 P17252_F1_nD3 | Protein kinase/SAICAR synthase/ATP-grasp RING/U-box-like Immunoglobulin-like beta-sandwich |
2ELI | Predicted | e2eliA1 | ||
3IW4 | Predicted | e3iw4A1 e3iw4C1 e3iw4B1 | ||
4DNL | Predicted | e4dnlA1 | ||
4RA4 | Predicted | e4ra4A1 |