PDB ligand accession: B49
DrugBank: DB01268
InChI Key: WINHZLLDWRZWRT-ATVHPVEESA-N
SMILES: CCN(CC)CCNC(=O)c1c(c([nH]c1C)C=C2c3cc(ccc3NC2=O)F)C
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolines
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P17948 | Download | Predicted | P17948_F1_nD8 | Protein kinase/SAICAR synthase/ATP-grasp |
1FLT | Predicted | e1fltX1 e1fltY1 | ||
1QSV | Predicted | e1qsvA1 | ||
1QSZ | Predicted | e1qszA1 | ||
1QTY | Predicted | e1qtyT1 e1qtyU1 e1qtyX1 e1qtyY1 | ||
1RV6 | Predicted | e1rv6X1 e1rv6Y1 | ||
2XAC | Predicted | e2xacC1 e2xacX1 | ||
3HNG | Predicted | e3hngA1 | ||
4CKV | Predicted | e4ckvX1 | ||
4CL7 | Predicted | e4cl7A1 e4cl7B1 e4cl7C1 e4cl7D1 | ||
5ABD | Predicted | e5abdI1 e5abdE1 e5abdX1 | ||
5T89 | Predicted | e5t89X3 e5t89Y3 e5t89Y5 e5t89X5 e5t89X1 e5t89Y1 e5t89X4 e5t89Y4 e5t89Y2 e5t89X2 |