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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Poly [ADP-ribose] polymerase tankyrase-2 | ||
| Ligand | BDBM50541719 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1985232 (CHEMBL4618638) | ||
| IC50 | 30±n/a nM | ||
| Citation |  Waaler, J; Leenders, RGG; Sowa, ST; Alam Brinch, S; Lycke, M; Nieczypor, P; Aertssen, S; Murthy, S; Galera-Prat, A; Damen, E; Wegert, A; Nazaré, M; Lehtiö, L; Krauss, S Preclinical Lead Optimization of a 1,2,4-Triazole Based Tankyrase Inhibitor. J Med Chem63:6834-6846 (2020) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Poly [ADP-ribose] polymerase tankyrase-2 | |||
| Name: | Poly [ADP-ribose] polymerase tankyrase-2 | ||
| Synonyms: | (ARTD6 or PARP5b) | PARP5B | Poly [ADP-ribose] polymerase tankyrase-2 | TANK2 | TNKL | TNKS2 | TNKS2_HUMAN | TPoly [ADP-ribose] polymerase tankyrase-2 | Tankyrase 2 | Tankyrase II | Tankyrase-2 | Tankyrase-2 (TNKS-2) | Tankyrase-2 (TNKS2) | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 126937.16 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q9H2K2 | ||
| Residue: | 1166 | ||
| Sequence: |
| ||
| BDBM50541719 | |||
| n/a | |||
| Name | BDBM50541719 | ||
| Synonyms: | CHEMBL4639158 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H17FN8O | ||
| Mol. Mass. | 452.4432 | ||
| SMILES | Fc1ccccc1-n1c(nnc1-c1ccncn1)[C@H]1C[C@@H](C1)n1c2ccc(cc2[nH]c1=O)C#N |r,wU:20.25,wD:18.20,(68.41,-6.37,;67.08,-7.14,;67.09,-8.68,;65.75,-9.45,;64.41,-8.68,;64.41,-7.14,;65.75,-6.37,;65.75,-4.83,;66.99,-3.93,;66.51,-2.46,;64.97,-2.46,;64.5,-3.93,;63.03,-4.4,;62.72,-5.9,;61.26,-6.38,;60.1,-5.35,;60.42,-3.84,;61.89,-3.36,;68.46,-4.4,;69.16,-5.78,;70.53,-5.08,;69.83,-3.71,;72,-5.56,;72.48,-7.01,;71.72,-8.35,;72.49,-9.67,;74.03,-9.67,;74.8,-8.34,;74.02,-7.02,;74.5,-5.55,;73.26,-4.64,;73.25,-3.1,;74.82,-11,;75.59,-12.33,)| | ||
| Structure | 
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