PDB ligand accession: 78P
DrugBank: DB07232
PubChem:
ChEMBL:
InChI Key: JNAHVYVRKWKWKQ-CYBMUJFWSA-N
SMILES: CC1(CCCN1)c2[nH]c3c(cccc3n2)C(=O)N
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzimidazoles
- Subclass: None
- Class: Benzimidazoles
- Superclass: Organoheterocyclic compounds
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | Q53GL7_78P | Q53GL7 | n/a | IC50(nM) = 1900.0 |
2 | P09874_78P | P09874 | n/a | Ki(nM) = 5.0 IC50(nM) = 1.0 Kd(nM) = 1.7 EC50(nM) = 2.0 |
3 | Q59FX0_78P | Q59FX0 | n/a | |
4 | Q9UGN5_78P | Q9UGN5 | n/a | IC50(nM) = 1.3 Kd(nM) = 5.8 |