Attributes
UniProt ID
Protein Name
Protein kinase, putative
Ligand Name
~{N}-[1-[(3~{R})-1-[4-(dimethylamino)but-2-enoyl]azepan-3-yl]-7-methyl-benzimidazol-2-yl]-2-methyl-pyridine-4-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SKLAQDNYYXAFGK-QWDXWUACSA-N
SMILES
Cc1cccc2c1n(c(n2)NC(=O)c3ccnc(c3)C)C4CCCCN(C4)C(=O)C=CCN(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: 6Q2A
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Color Legend
Unassigned regionsLigand / hetero atomse6q2aA1e6q2aB1e6q2aC1e6q2aD1e6q2aE1e6q2aF1e6q2aG1e6q2aH1e6q2aI1e6q2aJ1e6q2aK1e6q2aL1e6q2aM1e6q2aN1e6q2aO1e6q2aP1
ECOD domains from experimental PDB structures interacting with ligand 5XH
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q382U0 | n/a | 5XH | 6q2a | e6q2aA1 | A:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aB1 | B:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aC1 | C:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aD1 | D:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aE1 | E:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aF1 | F:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aG1 | G:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aH1 | H:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aI1 | I:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aJ1 | J:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aK1 | K:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aL1 | L:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aM1 | M:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aN1 | N:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aO1 | O:127-465 |
| Q382U0 | n/a | 5XH | 6q2a | e6q2aP1 | P:127-465 |