PDB ligand accession: AV9
DrugBank: DB11800
InChI Key: SPMVMDHWKHCIDT-UHFFFAOYSA-N
SMILES: CC1=CC(=NC(=O)Nc2ccc(cc2Cl)Oc3ccnc4c3cc(c(c4)OC)OC)NO1
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
Q13882 | Download | Predicted | Q13882_F1_nD2 Q13882_F1_nD3 Q13882_F1_nD1 | SH2 Protein kinase/SAICAR synthase/ATP-grasp SH3 |
1RJA | Predicted | e1rjaA1 | ||
2KGT | Predicted | e2kgtA1 | ||
5D7V | Predicted | e5d7vA1 e5d7vB1 e5d7vC1 e5d7vD1 | ||
5DA3 | Predicted | e5da3A1 | ||
5H2U | Predicted | e5h2uA1 e5h2uC1 e5h2uB1 e5h2uD1 | ||
6CZ2 | Predicted | e6cz2A1 | ||
6CZ3 | Predicted | e6cz3A1 | ||
6CZ4 | Predicted | e6cz4A1 |