PDB ligand accession: 0HD
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XEZOXLSEWZHMQY-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CCNC(=O)Nc2ccc3c(c2)cn[nH]3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3V8S | Download | Experimental | e3v8sA1 e3v8sB2 e3v8sC2 e3v8sD2 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |