Found 2 hits Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase tankyrase-2' and Ligand = 'BDBM50579955' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Poly [ADP-ribose] polymerase tankyrase-2
(Homo sapiens (Human)) | BDBM50579955
(CHEMBL5077249 | US11926614, Example 111)Show SMILES CC(C)Oc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccccn2)n1-c1ccccc1F |r,wU:16.19,wD:14.14,(56.07,-26.96,;56.97,-25.72,;56.35,-24.32,;58.5,-25.88,;59.4,-24.64,;60.94,-24.8,;61.83,-23.56,;61.21,-22.16,;59.68,-22,;58.78,-23.24,;62.11,-20.93,;61.64,-19.46,;62.88,-18.54,;64.13,-19.46,;65.59,-18.98,;66.97,-19.68,;67.68,-18.31,;66.3,-17.6,;69.15,-17.83,;69.47,-16.32,;68.32,-15.29,;70.94,-15.84,;71.24,-14.33,;72.71,-13.85,;73.87,-14.88,;73.55,-16.4,;72.08,-16.88,;63.65,-20.93,;64.55,-22.17,;63.92,-23.57,;64.83,-24.81,;66.35,-24.65,;66.98,-23.24,;66.07,-22,;66.69,-20.6,)| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase tankyrase-2
(Homo sapiens (Human)) | BDBM50579955
(CHEMBL5077249 | US11926614, Example 111)Show SMILES CC(C)Oc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccccn2)n1-c1ccccc1F |r,wU:16.19,wD:14.14,(56.07,-26.96,;56.97,-25.72,;56.35,-24.32,;58.5,-25.88,;59.4,-24.64,;60.94,-24.8,;61.83,-23.56,;61.21,-22.16,;59.68,-22,;58.78,-23.24,;62.11,-20.93,;61.64,-19.46,;62.88,-18.54,;64.13,-19.46,;65.59,-18.98,;66.97,-19.68,;67.68,-18.31,;66.3,-17.6,;69.15,-17.83,;69.47,-16.32,;68.32,-15.29,;70.94,-15.84,;71.24,-14.33,;72.71,-13.85,;73.87,-14.88,;73.55,-16.4,;72.08,-16.88,;63.65,-20.93,;64.55,-22.17,;63.92,-23.57,;64.83,-24.81,;66.35,-24.65,;66.98,-23.24,;66.07,-22,;66.69,-20.6,)| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human TNKS2 (873 to 1162 residues) incubated for 20 hrs in presence of NAD |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c01264
BindingDB Entry DOI: 10.7270/Q21R6VDH |
More data for this
Ligand-Target Pair | |
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