DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
n/a
Ligand Name
2-(4-(cyclohexylmethyl)piperazin-1-yl)-8-nitro-6-(trifluoromethyl)-4H-benzo[e][1,3]thiazin-4-one, bound form
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XXSIMQFFRSHXQZ-UHFFFAOYSA-N
SMILES
c1c(cc(c2c1C(=O)N=C(S2)N3CCN(CC3)CC4CCCCC4)NO)C(F)(F)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4NCR
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Color Legend
Unassigned regionsLigand / hetero atomse4ncrA5e4ncrA6e4ncrB1e4ncrB2
ECOD domains from experimental PDB structures interacting with ligand 26J
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P72056n/a26J4ncre4ncrA5A:195-461
P72056n/a26J4ncre4ncrA6A:6-194
P72056n/a26J4ncre4ncrB1B:8-194
P72056n/a26J4ncre4ncrB2B:195-268,B:298-461