Found 2 hits Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase tankyrase-2' and Ligand = 'BDBM50541702' 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)) | BDBM50541702
![PNG](/data/jpeg/tenK5054/BindingDB_50541702.png) (CHEMBL4646010 | US11926614, Example 189)Show SMILES Fc1ccc(nc1)C(=O)N[C@H]1C[C@@H](C1)c1nnc(-c2ccccn2)n1-c1ccccc1F |r,wU:10.10,wD:12.15,(79.97,-33.96,;78.51,-33.48,;78.18,-31.97,;76.72,-31.5,;75.59,-32.53,;75.9,-34.04,;77.36,-34.51,;74.12,-32.06,;73.8,-30.55,;72.98,-33.09,;71.51,-32.61,;70.14,-33.31,;69.44,-31.93,;70.81,-31.24,;67.98,-31.46,;67.5,-29.99,;65.96,-29.99,;65.49,-31.46,;64.03,-31.93,;63.71,-33.43,;62.25,-33.91,;61.1,-32.88,;61.42,-31.37,;62.88,-30.9,;66.73,-32.36,;66.74,-33.9,;65.4,-34.67,;65.4,-36.2,;66.73,-36.98,;68.07,-36.2,;68.07,-34.66,;69.4,-33.89,)| Show InChI InChI=1S/C23H18F2N6O/c24-15-8-9-19(27-13-15)23(32)28-16-11-14(12-16)21-29-30-22(18-6-3-4-10-26-18)31(21)20-7-2-1-5-17(20)25/h1-10,13-14,16H,11-12H2,(H,28,32)/t14-,16- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| | n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase tankyrase-2
(Homo sapiens (Human)) | BDBM50541702
![PNG](/data/jpeg/tenK5054/BindingDB_50541702.png) (CHEMBL4646010 | US11926614, Example 189)Show SMILES Fc1ccc(nc1)C(=O)N[C@H]1C[C@@H](C1)c1nnc(-c2ccccn2)n1-c1ccccc1F |r,wU:10.10,wD:12.15,(79.97,-33.96,;78.51,-33.48,;78.18,-31.97,;76.72,-31.5,;75.59,-32.53,;75.9,-34.04,;77.36,-34.51,;74.12,-32.06,;73.8,-30.55,;72.98,-33.09,;71.51,-32.61,;70.14,-33.31,;69.44,-31.93,;70.81,-31.24,;67.98,-31.46,;67.5,-29.99,;65.96,-29.99,;65.49,-31.46,;64.03,-31.93,;63.71,-33.43,;62.25,-33.91,;61.1,-32.88,;61.42,-31.37,;62.88,-30.9,;66.73,-32.36,;66.74,-33.9,;65.4,-34.67,;65.4,-36.2,;66.73,-36.98,;68.07,-36.2,;68.07,-34.66,;69.4,-33.89,)| Show InChI InChI=1S/C23H18F2N6O/c24-15-8-9-19(27-13-15)23(32)28-16-11-14(12-16)21-29-30-22(18-6-3-4-10-26-18)31(21)20-7-2-1-5-17(20)25/h1-10,13-14,16H,11-12H2,(H,28,32)/t14-,16- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description Inhibition of human TNKS2 (873 to 1162 residues) measured after 20 hrs in presence of NAD+ by fluorescence assay |
J Med Chem 63: 6834-6846 (2020)
Article DOI: 10.1021/acs.jmedchem.0c00208 BindingDB Entry DOI: 10.7270/Q2RR22SX |
More data for this Ligand-Target Pair | |