PDB ligand accession: SB4
DrugBank: DB04338
PubChem:
ChEMBL:
InChI Key: VSPFURGQAYMVAN-UHFFFAOYSA-N
SMILES: c1cc(ccc1c2c(n(cn2)C3CCNCC3)c4ccnc(n4)N)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Imidazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6Y85 | Download | Experimental | e6y85A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6SP9 | Download | Experimental | e6sp9A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6Y7X | Download | Experimental | e6y7xA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6YCU | Download | Experimental | e6ycuA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
4LOP | Download | Experimental | e4lopA1 e4lopB1 e4lopC1 e4lopD1 | 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 |
6SPL | Download | Experimental | e6splA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6Y81 | Download | Experimental | e6y81A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6Y8H | Download | Experimental | e6y8hA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
4LOO | Download | Experimental | e4looA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6Y7Y | Download | Experimental | e6y7yA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6Y82 | Download | Experimental | e6y82A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
4LOQ | Download | Experimental | e4loqA1 e4loqB1 e4loqC1 e4loqD1 | 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 |
5O90 | Download | Experimental | e5o90A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6YCW | Download | Experimental | e6ycwA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6Y7Z | Download | Experimental | e6y7zA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6Y7W | Download | Experimental | e6y7wA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6SOV | Download | Experimental | e6sovA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6Y80 | Download | Experimental | e6y80A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |