Found 2 hits Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase tankyrase-2' and Ligand = 'BDBM50579964' 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)) | BDBM50579964
(CHEMBL5077896 | US11926614, Example 162)Show SMILES CCOc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccnc3cccnc23)n1-c1cccnc1 |r,wU:15.18,wD:13.13,(37.11,-11.4,;37.73,-12.81,;39.26,-12.97,;40.16,-11.73,;41.7,-11.89,;42.6,-10.65,;41.98,-9.25,;40.45,-9.08,;39.54,-10.32,;42.87,-8.01,;42.4,-6.54,;43.64,-5.63,;44.9,-6.54,;46.36,-6.06,;47.74,-6.76,;48.44,-5.39,;47.07,-4.68,;49.91,-4.92,;50.24,-3.41,;49.09,-2.37,;51.71,-2.92,;52.01,-1.41,;53.48,-.93,;54.64,-1.96,;54.32,-3.48,;55.46,-4.5,;55.14,-6.01,;53.67,-6.49,;52.53,-5.45,;52.85,-3.95,;44.42,-8.01,;45.32,-9.25,;44.69,-10.65,;45.59,-11.9,;47.12,-11.74,;47.75,-10.32,;46.84,-9.09,)| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.5 | 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)) | BDBM50579964
(CHEMBL5077896 | US11926614, Example 162)Show SMILES CCOc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccnc3cccnc23)n1-c1cccnc1 |r,wU:15.18,wD:13.13,(37.11,-11.4,;37.73,-12.81,;39.26,-12.97,;40.16,-11.73,;41.7,-11.89,;42.6,-10.65,;41.98,-9.25,;40.45,-9.08,;39.54,-10.32,;42.87,-8.01,;42.4,-6.54,;43.64,-5.63,;44.9,-6.54,;46.36,-6.06,;47.74,-6.76,;48.44,-5.39,;47.07,-4.68,;49.91,-4.92,;50.24,-3.41,;49.09,-2.37,;51.71,-2.92,;52.01,-1.41,;53.48,-.93,;54.64,-1.96,;54.32,-3.48,;55.46,-4.5,;55.14,-6.01,;53.67,-6.49,;52.53,-5.45,;52.85,-3.95,;44.42,-8.01,;45.32,-9.25,;44.69,-10.65,;45.59,-11.9,;47.12,-11.74,;47.75,-10.32,;46.84,-9.09,)| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.5 | 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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