DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Apoptosis regulator Bcl-2
Ligand Name
4-{4-[(4'-chloro-5,5-dimethyl[3,4,5,6-tetrahydro[1,1'-biphenyl]]-2-yl)methyl]piperazin-1-yl}-N-[(3-nitro-4-{[(oxan-4-yl )methyl]amino}phenyl)sulfonyl]-2-[(1H-pyrrolo[2,3-b]pyridin-5-yl)oxy]benzamide
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LQBVNQSMGBZMKD-UHFFFAOYSA-N
SMILES
CC1(CCC(=C(C1)c2ccc(cc2)Cl)CN3CCN(CC3)c4ccc(c(c4)Oc5cc6cc[nH]c6nc5)C(=O)NS(=O)(=O)c7ccc(c(c7)[N+](=O)[O-])NCC8CCOCC8)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 6O0K
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Color Legend
Unassigned regionsLigand / hetero atomse6o0kA1
ECOD domains from experimental PDB structures interacting with ligand DB11581
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P10415DB11581LBM6o0ke6o0kA1A:9-203
P10415DB11581LBM6o0le6o0lA1A:9-203
P10415DB11581LBM6o0le6o0lC1C:8-203
P10415DB11581LBM6o0me6o0mA1A:8-203
P10415DB11581LBM6o0pe6o0pA1A:9-203