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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Poly [ADP-ribose] polymerase tankyrase-2 | ||
| Ligand | BDBM50579961 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2146090 (CHEMBL5030370) | ||
| IC50 | 12±n/a nM | ||
| Citation |  Leenders, RGG; Brinch, SA; Sowa, ST; Amundsen-Isaksen, E; Galera-Prat, A; Murthy, S; Aertssen, S; Smits, JN; Nieczypor, P; Damen, E; Wegert, A; Nazaré, M; Lehtiö, L; Waaler, J; Krauss, S Development of a 1,2,4-Triazole-Based Lead Tankyrase Inhibitor: Part II. J Med Chem64:17936-17949 (2021) [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: |
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| BDBM50579961 | |||
| n/a | |||
| Name | BDBM50579961 | ||
| Synonyms: | CHEMBL5078514 | US11926614, Example 75 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H21ClN6O2S | ||
| Mol. Mass. | 480.97 | ||
| SMILES | CCOc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccccn2)n1-c1ccc(Cl)s1 |r,wU:15.18,wD:13.13,(20.51,-57.52,;21.41,-56.28,;22.94,-56.44,;23.84,-55.2,;25.38,-55.36,;26.27,-54.12,;25.65,-52.72,;24.13,-52.56,;23.22,-53.8,;26.55,-51.49,;26.08,-50.02,;27.32,-49.11,;28.57,-50.02,;30.03,-49.54,;31.41,-50.25,;32.11,-48.87,;30.74,-48.17,;33.58,-48.4,;33.9,-46.89,;32.75,-45.86,;35.37,-46.41,;35.68,-44.9,;37.14,-44.42,;38.3,-45.45,;37.98,-46.96,;36.51,-47.44,;28.09,-51.49,;28.99,-52.74,;28.52,-54.2,;29.76,-55.1,;31,-54.2,;32.46,-54.67,;30.53,-52.74,)| | ||
| Structure | 
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