PDB ligand accession: XIN
DrugBank: DB09079
InChI Key: XZXHXSATPCNXJR-ZIADKAODSA-N
SMILES: CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)NC(=C3c4ccc(cc4NC3=O)C(=O)OC)c5ccccc5
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolecarboxylic acids and derivatives
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P07948 | Download | Predicted | P07948_F1_nD3 P07948_F1_nD1 P07948_F1_nD2 | Protein kinase/SAICAR synthase/ATP-grasp SH3 SH2 |
1W1F | Predicted | e1w1fA1 | ||
1WA7 | Predicted | e1wa7A1 | ||
3A4O | Predicted | e3a4oX1 | ||
5XY1 | Predicted | e5xy1A1 | ||
6NMW | Predicted | e6nmwA1 |