PDB ligand accession: JCY
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YEOAAQMCKFJWKF-UHFFFAOYSA-N
SMILES: Cc1c(c(n(n1)C)C)CCOc2cc(ccc2c3ccc4c(c3)c(nn4C)CN(C)C)F
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 |
---|---|---|---|---|---|
6MB1 | Download | Experimental | e6mb1A1 e6mb1A2 e6mb1B1 e6mb1B2 e6mb1C1 e6mb1C2 | Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy | LigPlot |
6MB0 | Download | Experimental | e6mb0A1 e6mb0A2 e6mb0B1 e6mb0B2 e6mb0C1 e6mb0C2 | Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy | LigPlot |