Medvedev Lab DrugDomain Protein List Small Molecules Download GitHub
Ligand name: 4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide
PDB ligand accession: B3N
DrugBank: DB02565
PubChem: 3994
ChEMBL: CHEMBL140000
InChI Key: MXWDSZWTBOCWBK-UHFFFAOYSA-N
SMILES: CN(C)c1ccc(cc1)C(=O)NCCCCCCC(=O)NO
Drug action: n/a

ClassyFire chemical classification:

List of PDB structures and/or AlphaFold models with target protein Q9BY41

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
3F06 Download Experimental e3f06A1
e3f06B1
 HAD domain-related
HAD domain-related
LigPlot
3MZ4 Download Experimental e3mz4A1
e3mz4B1
 HAD domain-related
HAD domain-related
LigPlot
5DC5 Download Experimental e5dc5A1
e5dc5B1
 HAD domain-related
HAD domain-related
LigPlot
5THS Download Experimental e5thsA1
e5thsB1
 HAD domain-related
HAD domain-related
LigPlot
4QA4 Download Experimental e4qa4A1
 HAD domain-related
LigPlot
1T67 Download Experimental e1t67A1
 HAD domain-related
LigPlot
3MZ3 Download Experimental e3mz3A1
e3mz3B1
 HAD domain-related
HAD domain-related
LigPlot
3MZ7 Download Experimental e3mz7A1
 HAD domain-related
LigPlot
5THT Download Experimental e5thtA1
e5thtB1
e5thtC1
e5thtD1
 HAD domain-related
HAD domain-related
HAD domain-related
HAD domain-related
LigPlot
3EW8 Download Experimental e3ew8A1
 HAD domain-related
LigPlot
7JVW Download Experimental e7jvwA1
e7jvwB1
 HAD domain-related
HAD domain-related
LigPlot
4QA1 Download Experimental e4qa1A1
e4qa1B1
e4qa1C1
e4qa1D1
 HAD domain-related
HAD domain-related
HAD domain-related
HAD domain-related
LigPlot
3MZ6 Download Experimental e3mz6A1
 HAD domain-related
LigPlot
5THU Download Experimental e5thuA1
e5thuB1
 HAD domain-related
HAD domain-related
LigPlot
3EZT Download Experimental e3eztA1
e3eztB1
 HAD domain-related
HAD domain-related
LigPlot
3EZP Download Experimental e3ezpA1
e3ezpB1
 HAD domain-related
HAD domain-related
LigPlot
5THV Download Experimental e5thvA1
e5thvB1
 HAD domain-related
HAD domain-related
LigPlot