PDB ligand accession: JK6
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: NWZBOILRLALTAS-UHFFFAOYSA-N
SMILES: C#Cc1cccc(c1)n2c(ccn2)C3=NN(C=CC3=O)c4ccccc4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5SHZ | Download | Experimental | e5shzA1 e5shzB1 e5shzC1 e5shzD1 | PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |