PDB ligand accession: CG7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MEZQZPGDJJEQPZ-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1C(=O)O)Oc2[nH]c3cc(c(nc3n2)c4ccc(cc4)c5ccccc5O)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Biphenyls and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6B1U | Download | Experimental | e6b1uA1 e6b1uB1 e6b1uD2 e6b1uC2 | Protein kinase/SAICAR synthase/ATP-grasp Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6B2E | Download | Experimental | e6b2eB2 e6b2eA1 | Immunoglobulin-like beta-sandwich Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |