Reaction Details | |||
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Target | Potassium voltage-gated channel subfamily H member 2 | ||
Ligand | BDBM50131431 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_158540 (CHEMBL766814) | ||
IC50 | 5888±n/a nM | ||
Citation | Keserü, GM Prediction of hERG potassium channel affinity by traditional and hologram qSAR methods. Bioorg Med Chem Lett13:2773-5 (2003) [PubMed] | ||
More Info.: | Get all data from this article, Assay Method | ||
Potassium voltage-gated channel subfamily H member 2 | |||
Name: | Potassium voltage-gated channel subfamily H member 2 | ||
Synonyms: | 1,3-beta-glucan synthase component GLS2 | Cytochrome P450 3A4 | ERG | ERG1 | Eag-related protein 1 | Ether a-go-go related gene potassium channel (hERG) | Ether-a-go-go-related gene (HERG) | Ether-a-go-go-related gene potassium channel (hERG) | Ether-a-go-go-related gene potassium channel 1 | Ether-a-go-go-related gene potassium channel 1 (HERG) | Ether-a-go-go-related gene potassium channel 1 (hERG1) | Ether-a-go-go-related protein (hERG) | Ether-a-go-go-related protein 1 | Ether-a-go-go-related protein 1 (HERG) | H-ERG | HERG | KCNH2 | KCNH2_HUMAN | Potassium voltage-gated channel subfamily H member 2 (hERG) | Transcriptional regulator ERG | Voltage-gated potassium channel subunit Kv11.1 | eag homolog | hERG Potassium Channel 1 | putative potassium channel subunit | ||
Type: | Multi-pass membrane protein | ||
Mol. Mass.: | 126672.65 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Q12809 | ||
Residue: | 1159 | ||
Sequence: |
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BDBM50131431 | |||
n/a | |||
Name | BDBM50131431 | ||
Synonyms: | 2,3-Dihydro-1H-indole-3-carboxylic acid (3S,7S)-10-oxo-8-aza-tricyclo[5.3.1.0*3,8*]undec-5-yl ester | CHEMBL319742 | ||
Type | Small organic molecule | ||
Emp. Form. | C19H22N2O3 | ||
Mol. Mass. | 326.3896 | ||
SMILES | O=C(OC1C[C@@H]2CC3C[C@@H](C1)N2CC3=O)C1CNc2ccccc12 |wD:9.11,5.12,TLB:14:13:5.6:9.8,12:11:3.4.10:7.6.8,(.12,-10.83,;.12,-9.28,;1.46,-8.5,;2.81,-9.27,;2.81,-10.81,;4.12,-11.58,;4.12,-10.04,;8.12,-9.28,;6.79,-8.5,;5.46,-9.27,;4.12,-8.5,;5.46,-10.81,;6.79,-11.58,;8.12,-10.83,;9.45,-11.6,;-1.21,-8.51,;-1.37,-6.97,;-2.89,-6.65,;-3.64,-7.98,;-5.14,-8.31,;-5.63,-9.77,;-4.58,-10.92,;-3.09,-10.59,;-2.61,-9.13,)| | ||
Structure |