PDB ligand accession: 1N1
DrugBank: DB01254
InChI Key: ZBNZXTGUTAYRHI-UHFFFAOYSA-N
SMILES: Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P51692 | Download | Predicted | P51692_F1_nD5 P51692_F1_nD4 | SH2 EF-hand |
6MBW | Predicted | e6mbwA2 e6mbwB4 e6mbwA3 e6mbwB1 e6mbwA4 e6mbwB3 e6mbwA1 e6mbwB2 | ||
6MBZ | Predicted | e6mbzA4 e6mbzB3 e6mbzA2 e6mbzB1 e6mbzA3 e6mbzB2 e6mbzA1 e6mbzB4 |