PDB ligand accession: 2VU
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LBYBJJIMARLHMV-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)C#N)Cn2cc(cn2)NC(=O)c3c4ccc(cc4[nH]n3)c5c[nH]nc5
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
# | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
---|---|---|---|---|---|
1 | O14965_2VU | O14965 | Aurora kinase A | n/a | |
2 | Q08881_2VU | Q08881 | Tyrosine-protein kinase ITK/TSK | n/a |