Found 2 hits Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase tankyrase-2' and Ligand = 'BDBM50579967' 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)) | BDBM50579967
(CHEMBL5082990 | US11926614, Example 170)Show SMILES CCOc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccnc3cc(F)cnc23)n1-c1ccncc1 |r,wU:15.18,wD:13.13,(18.68,-26.64,;19.58,-25.4,;21.11,-25.56,;22.01,-24.32,;23.55,-24.48,;24.45,-23.23,;23.83,-21.83,;22.3,-21.67,;21.39,-22.91,;24.73,-20.6,;24.26,-19.13,;25.5,-18.21,;26.75,-19.13,;28.21,-18.64,;29.59,-19.35,;30.3,-17.97,;28.92,-17.27,;31.77,-17.5,;32.09,-15.99,;30.94,-14.95,;33.56,-15.51,;33.87,-14,;35.33,-13.51,;36.5,-14.55,;36.18,-16.06,;37.32,-17.09,;37,-18.59,;38.14,-19.62,;35.53,-19.08,;34.38,-18.04,;34.71,-16.53,;26.27,-20.6,;27.17,-21.84,;26.54,-23.24,;27.44,-24.48,;28.97,-24.33,;29.6,-22.91,;28.69,-21.68,)| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 2.90 | 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)) | BDBM50579967
(CHEMBL5082990 | US11926614, Example 170)Show SMILES CCOc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccnc3cc(F)cnc23)n1-c1ccncc1 |r,wU:15.18,wD:13.13,(18.68,-26.64,;19.58,-25.4,;21.11,-25.56,;22.01,-24.32,;23.55,-24.48,;24.45,-23.23,;23.83,-21.83,;22.3,-21.67,;21.39,-22.91,;24.73,-20.6,;24.26,-19.13,;25.5,-18.21,;26.75,-19.13,;28.21,-18.64,;29.59,-19.35,;30.3,-17.97,;28.92,-17.27,;31.77,-17.5,;32.09,-15.99,;30.94,-14.95,;33.56,-15.51,;33.87,-14,;35.33,-13.51,;36.5,-14.55,;36.18,-16.06,;37.32,-17.09,;37,-18.59,;38.14,-19.62,;35.53,-19.08,;34.38,-18.04,;34.71,-16.53,;26.27,-20.6,;27.17,-21.84,;26.54,-23.24,;27.44,-24.48,;28.97,-24.33,;29.6,-22.91,;28.69,-21.68,)| | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.90 | 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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