Reaction Details | |||
---|---|---|---|
Report a problem with these data | |||
Target | Poly [ADP-ribose] polymerase tankyrase-2 | ||
Ligand | BDBM50250876 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEBML_1682547 | ||
IC50 | 330±n/a nM | ||
Citation | Anumala, UR; Waaler, J; Nkizinkiko, Y; Ignatev, A; Lazarow, K; Lindemann, P; Olsen, PA; Murthy, S; Obaji, E; Majouga, AG; Leonov, S; von Kries, JP; Lehtiö, L; Krauss, S; Nazaré, M Discovery of a Novel Series of Tankyrase Inhibitors by a Hybridization Approach. J Med Chem60:10013-10025 (2017) [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: |
| ||
BDBM50250876 | |||
n/a | |||
Name | BDBM50250876 | ||
Synonyms: | CHEMBL4102763 | ||
Type | Small organic molecule | ||
Emp. Form. | C26H21ClN8O | ||
Mol. Mass. | 496.951 | ||
SMILES | Clc1ccccc1-n1c(nnc1-c1ccncn1)[C@H]1CC[C@@H](CC1)n1c2ccc(cc2[nH]c1=O)C#N |r,wU:21.27,wD:18.20,(22.84,-14.09,;21.51,-14.87,;21.51,-16.4,;20.17,-17.18,;18.84,-16.4,;18.84,-14.87,;20.17,-14.09,;20.17,-12.09,;21.42,-11.18,;20.95,-9.72,;19.4,-9.72,;18.93,-11.18,;17.46,-11.67,;17.14,-13.17,;15.68,-13.64,;14.53,-12.62,;14.85,-11.11,;16.32,-10.63,;22.88,-11.67,;23.21,-13.17,;24.67,-13.64,;25.82,-12.62,;25.5,-11.11,;24.03,-10.63,;27.28,-13.09,;27.76,-14.55,;26.98,-15.89,;27.76,-17.22,;29.3,-17.22,;30.07,-15.89,;29.3,-14.55,;29.78,-13.09,;28.53,-12.18,;28.53,-10.65,;30.07,-18.57,;30.84,-19.91,)| | ||
Structure |