Ligand name: 4-({6-AMINO-5-BROMO-2-[(4-CYANOPHENYL)AMINO]PYRIMIDIN-4-YL}OXY)-3,5-DIMETHYLBENZONITRILE
PDB ligand accession: 65B
DrugBank: DB06414
PubChem: 193962
ChEMBL: CHEMBL308954
InChI Key: PYGWGZALEOIKDF-UHFFFAOYSA-N
SMILES: Cc1cc(cc(c1Oc2c(c(nc(n2)Nc3ccc(cc3)C#N)N)Br)C)C#N
Drug action: modulator

ClassyFire chemical classification:

List of PDB structures and/or AlphaFold models with target protein P03366

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
1SV5 Download Experimental e1sv5A4
e1sv5A2
e1sv5B2
Ribonuclease H-like
Alpha-beta plaits
Alpha-beta plaits
LigPlot