DrugDomain logoDrugDomain

Attributes

UniProt ID
P00519
Protein Name
Tyrosine-protein kinase ABL1
Ligand Name
4-(4-METHYL-PIPERAZIN-1-YLMETHYL)-N-[4-METHYL-3-(4-PYRIDIN-3-YL-PYRIMIDIN-2-YLAMINO)-PHENYL]-BENZAMIDE
DrugBank ID
DB00619
PDB Ligand Accession
STI
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
KTUFNOKKBVMGRW-UHFFFAOYSA-N
SMILES
Cc1ccc(cc1Nc2nccc(n2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Mol*
Structure: 2HYY
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Color Legend
Unassigned regionsLigand / hetero atomse2hyyA1e2hyyB1e2hyyC1e2hyyD1
ECOD domains from experimental PDB structures interacting with ligand DB00619
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P00519DB00619STI2hyye2hyyA1A:235-498
P00519DB00619STI2hyye2hyyB1B:233-498
P00519DB00619STI2hyye2hyyC1C:233-498
P00519DB00619STI2hyye2hyyD1D:233-498
P00519DB00619STI6npee6npeA1A:251-519
P00519DB00619STI6npee6npeB1B:252-530
P00519DB00619STI6npue6npuA1A:251-519
P00519DB00619STI6npue6npuB1B:252-529
P00519DB00619STI6npve6npvA1A:251-519
P00519DB00619STI6npve6npvB1B:252-529
P00519DB00619STI7n9ge7n9gA1A:252-517
P00519DB00619STI7n9ge7n9gB1B:252-517
P00519DB00619STI7n9ge7n9gC1C:253-518