PDB ligand accession: RSA
DrugBank: DB03894
PubChem:
ChEMBL:
InChI Key: RUOKEQAAGRXIBM-LBPRGKRZSA-N
SMILES: C#CCNC1CCc2c1cccc2
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Indanes
- Subclass: None
- Class: Indanes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2C72 | Download | Experimental | e2c72A1 e2c72A2 e2c72B1 e2c72B2 | FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like | LigPlot |
2C73 | Download | Experimental | e2c73A1 e2c73A2 e2c73B1 e2c73B2 | FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like | LigPlot |
2C75 | Download | Experimental | e2c75A1 e2c75A2 e2c75B1 e2c75B2 | FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like | LigPlot |
2C76 | Download | Experimental | e2c76A1 e2c76A2 e2c76B1 e2c76B2 | FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like | LigPlot |
1S2Y | Download | Experimental | e1s2yA1 e1s2yA2 e1s2yB1 e1s2yB2 | FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like | LigPlot |