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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | DNA-dependent protein kinase catalytic subunit | ||
| Ligand | BDBM50594891 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2214617 (CHEMBL5127749) | ||
| Ki | <100±n/a nM | ||
| Citation |  Cheng, B; Pan, W; Xing, Y; Xiao, Y; Chen, J; Xu, Z Recent advances in DDR (DNA damage response) inhibitors for cancer therapy. Eur J Med Chem230:0 (2022) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| DNA-dependent protein kinase catalytic subunit | |||
| Name: | DNA-dependent protein kinase catalytic subunit | ||
| Synonyms: | DNA-PK catalytic subunit | DNA-PKcs | DNA-dependent protein kinase (DNA-PK) | DNA-dependent protein kinase (DNPK) | DNA-dependent protein kinase catalytic subunit (DNA-PK) | DNPK1 | HYRC | HYRC1 | PRKDC | PRKDC_HUMAN | ||
| Type: | Protein | ||
| Mol. Mass.: | 469114.78 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P78527 | ||
| Residue: | 4128 | ||
| Sequence: |
| ||
| BDBM50594891 | |||
| n/a | |||
| Name | BDBM50594891 | ||
| Synonyms: | CHEMBL5171087 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H28N6O2 | ||
| Mol. Mass. | 420.5074 | ||
| SMILES | C[C@@H]1CN(CCO1)c1cc(O[C@@H]2CC[C@@H](CC2)Nc2ncccn2)c2nccnc2c1 |r,wU:11.11,14.18,1.0,(6.01,-5,;4.68,-4.23,;4.68,-2.69,;3.35,-1.92,;2.01,-2.69,;2.01,-4.23,;3.35,-5,;3.35,-.38,;2.01,.38,;1.99,1.91,;.66,2.68,;-.67,1.91,;-2.01,2.68,;-3.34,1.91,;-3.34,.37,;-2.01,-.4,;-.67,.37,;-4.67,-.4,;-4.67,-1.94,;-3.34,-2.71,;-3.34,-4.24,;-4.68,-5.01,;-6,-4.25,;-6.01,-2.71,;3.33,2.7,;3.33,4.24,;4.66,5.01,;5.99,4.24,;5.99,2.7,;4.67,1.93,;4.67,.4,)| | ||
| Structure | 
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