BDBM649480 US11891378, Example 10

SMILES C[C@@H]1CN(CCN1C(=O)Cc2ccc(cc2)C3CC3)c4ccc(nn4)Cl

InChI Key InChIKey=FXRACXMJXSMNQI-UHFFFAOYSA-N

Data  1 IC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 649480   

TargetPantothenate kinase 3(Human)
St. Jude Children'S Research Hospital

US Patent
LigandPNGBDBM649480(US11891378, Example 10)
Affinity DataIC50: 3.80nMAssay Description:The assay is not clearly defined.More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/8/2024
Entry Details
Go to US Patent
PDB3D3D Structure (crystal)