Attributes
UniProt ID
Protein Name
Bromodomain-containing protein 4
Ligand Name
N-{3-[1-(4-{[3-(cyclopropylamino)-3-oxopropyl](methyl)amino}-6-{methyl[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]amino}-1,3,5-triazin-2-yl)piperidin-4-yl]propanoyl}-3-methyl-L-valyl-(4R)-4-hydroxy-N-{[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}-L-prolinamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NCTRMGWBUJFIPQ-ZJMRITFWSA-N
SMILES
Cc1c(c(n(n1)C)C)CN(C)c2nc(nc(n2)N(C)CCC(=O)NC3CC3)N4CCC(CC4)CCC(=O)NC(C(=O)N5CC(CC5C(=O)NCc6ccc(cc6)c7c(ncs7)C)O)C(C)(C)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 8EWV
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse8ewvA1e8ewvB1e8ewvC1e8ewvC2e8ewvD1e8ewvE1e8ewvF1e8ewvG1e8ewvG2e8ewvH1e8ewvI1e8ewvJ1e8ewvK1e8ewvK2e8ewvL1e8ewvM1e8ewvN1e8ewvO1e8ewvO2e8ewvP1e8ewvQ1e8ewvR1e8ewvS1e8ewvS2e8ewvT1e8ewvU1e8ewvV1e8ewvW1e8ewvW2e8ewvX1
ECOD domains from experimental PDB structures interacting with ligand X5K