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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 379.4
BDBM649473

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Pantothenate kinase 3


(Homo sapiens (Human))
BDBM649473
PNG
(US11891378, Example 3)
Show SMILES C[C@H]1CN(CCN1C(=O)Cc1ccc(C2CC2)c(F)c1)c1ccc(nn1)C#N |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 6.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair