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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Potassium voltage-gated channel subfamily E/KQT member 1 | ||
| Ligand | BDBM50370682 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1478601 (CHEMBL3430502) | ||
| IC50 | 31623±n/a nM | ||
| Citation |  Mirams, GR; Davies, MR; Brough, SJ; Bridgland-Taylor, MH; Cui, Y; Gavaghan, DJ; Abi-Gerges, N Prediction of Thorough QT study results using action potential simulations based on ion channel screens. J Pharmacol Toxicol Methods70:246-54 (2014) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Potassium voltage-gated channel subfamily E/KQT member 1 | |||
| Name: | Potassium voltage-gated channel subfamily E/KQT member 1 | ||
| Synonyms: | Voltage-gated potassium channel beta subunit Mink/subunit Kv7.1 | Voltage-gated potassium channel, IKs; KCNQ1(Kv7.1)/KCNE1(MinK) | ||
| Type: | n/a | ||
| Mol. Mass.: | n/a | ||
| Description: | ASSAY_ID of EBI is 158552 | ||
| Components: | This complex has 2 components. | ||
| Component 1 | |||
| Name: | Potassium voltage-gated channel subfamily E member 1 | ||
| Synonyms: | Delayed rectifier potassium channel subunit IsK | IKs producing slow voltage-gated potassium channel subunit beta Mink | KCNE1 | KCNE1_HUMAN | KCNQ1(Kv7.1)/KCNE1(MinK) | Minimal potassium channel | Voltage-gated potassium channel beta subunit Mink | Voltage-gated potassium channel, IKs | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 14676.11 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | ChEMBL_1456351 | ||
| Residue: | 129 | ||
| Sequence: |
| ||
| Component 2 | |||
| Name: | Potassium voltage-gated channel subfamily KQT member 1 | ||
| Synonyms: | KCNA8 | KCNA9 | KCNQ (Kv7) potassium channel | KCNQ1 | KCNQ1_HUMAN | KVLQT1 | Voltage-gated potassium channel subunit Kv7.1 | Voltage-gated potassium channel subunit Kv7.1/Misshapen-like kinase 1 | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 74739.00 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | ChEMBL_1454245 | ||
| Residue: | 676 | ||
| Sequence: |
| ||
| BDBM50370682 | |||
| n/a | |||
| Name | BDBM50370682 | ||
| Synonyms: | SOLIFENACIN | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H26N2O2 | ||
| Mol. Mass. | 362.4647 | ||
| SMILES | [H]C12CCN(CC1)C[C@@H]2OC(=O)N1CCc2ccccc2[C@@H]1c1ccccc1 |wD:8.10,21.25,TLB:9:8:2.3:6.5,(23.54,-9.18,;23.57,-7.64,;22.04,-8.3,;21.84,-6.92,;23.31,-6.28,;23.38,-4.63,;23.82,-5.74,;24.65,-6.88,;24.94,-8.28,;24.93,-9.81,;23.59,-10.56,;22.26,-9.79,;23.59,-12.1,;24.92,-12.9,;24.88,-14.45,;23.53,-15.19,;23.52,-16.72,;22.17,-17.47,;20.85,-16.68,;20.87,-15.14,;22.21,-14.39,;22.23,-12.84,;20.91,-12.06,;19.57,-12.81,;18.25,-12.02,;18.28,-10.47,;19.62,-9.73,;20.94,-10.52,)| | ||
| Structure | 
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