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Attributes

UniProt ID
Protein Name
Tyrosine-protein kinase BTK
Ligand Name
N-[2-methyl-3-[4-methyl-6-[4-(4-methylpiperazine-1-carbonyl)anilino]-5-oxo-pyrazin-2-yl]phenyl]-4-(1-piperidyl)benzamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VDSHGYXLLSEPML-UHFFFAOYSA-N
SMILES
Cc1c(cccc1NC(=O)c2ccc(cc2)N3CCCCC3)C4=CN(C(=O)C(=N4)Nc5ccc(cc5)C(=O)N6CCN(CC6)C)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 6EP9
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Color Legend
Unassigned regionsLigand / hetero atomse6ep9A1
ECOD domains from experimental PDB structures interacting with ligand BNB
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q06187n/aBNB6ep9e6ep9A1A:396-658