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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Voltage-dependent L-type calcium channel subunit beta-3/N-type calcium channel subunit alpha-1B/calcium channel subunit alpha-2/delta-1 | ||
| Ligand | BDBM246351 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Functional Drug Screening System (FDSS) | ||
| IC50 | 14±n/a nM | ||
| Citation |  Wall, M; Subasinghe, N; Sui, Z; Flores, C Substituted pyrazoles as N-type calcium channel blockers US Patent US9434693 Publication Date 9/6/2016 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Voltage-dependent L-type calcium channel subunit beta-3/N-type calcium channel subunit alpha-1B/calcium channel subunit alpha-2/delta-1 | |||
| Name: | Voltage-dependent L-type calcium channel subunit beta-3/N-type calcium channel subunit alpha-1B/calcium channel subunit alpha-2/delta-1 | ||
| Synonyms: | N-type calcium channel subunits alpha 1B (Cav2.2) Beta 3 and Alpha 2 Delta | N-type calcium channel subunits alpha 1B (Cav2.2), Beta 3, and Alpha 2 Delta | ||
| Type: | Enzyme | ||
| Mol. Mass.: | n/a | ||
| Description: | n/a | ||
| Components: | This complex has 3 components. | ||
| Component 1 | |||
| Name: | Voltage-dependent N-type calcium channel subunit alpha-1B | ||
| Synonyms: | BIII | Brain calcium channel III | CAC1B_HUMAN | CACH5 | CACNA1B | CACNL1A5 | Calcium channel (Type N) | Calcium channel, L type, alpha-1 polypeptide isoform 5 | Voltage-dependent N-type calcium channel subunit alpha-1B | Voltage-dependent N-type calcium channel subunit alpha-1B/Voltage-dependent calcium channel subunit alpha-2/delta-1/Voltage-dependent L-type calcium channel subunit beta-3 | Voltage-gated N-type calcium channel alpha-1B subunit | Voltage-gated N-type calcium channel alpha-1B subunit/Amyloid beta A4 precursor protein-binding family A member 1 | Voltage-gated calcium channel | Voltage-gated calcium channel subunit alpha Cav2.2 | Voltage-gated calcium channel subunit alpha Cav2.2 ((alpha 1B, beta 1b, alpha 2 delta-1) | calcium channel, voltage-dependent, N type, alpha 1B subunit | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 262548.16 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q00975 | ||
| Residue: | 2339 | ||
| Sequence: |
| ||
| Component 2 | |||
| Name: | Voltage-dependent L-type calcium channel subunit beta-3 | ||
| Synonyms: | CACB3_HUMAN | CACNB3 | CACNLB3 | Calcium channel voltage-dependent subunit beta 3 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 54529.25 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P54284 | ||
| Residue: | 484 | ||
| Sequence: |
| ||
| Component 3 | |||
| Name: | Voltage-dependent calcium channel subunit alpha-2/delta-1 | ||
| Synonyms: | CA2D1_HUMAN | CACNA2D1 | CACNL2A | CCHL2A | MHS3 | Voltage-dependent calcium channel subunit alpha-2-1 | Voltage-dependent calcium channel subunit delta-1 | Voltage-gated calcium channel | Voltage-gated calcium channel alpha2/delta subunit 1 | Voltage-gated calcium channel subunit alpha-2/delta-1 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 124544.88 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P54289 | ||
| Residue: | 1103 | ||
| Sequence: |
| ||
| BDBM246351 | |||
| n/a | |||
| Name | BDBM246351 | ||
| Synonyms: | US9434693, 46 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C26H29N3O3S | ||
| Mol. Mass. | 463.592 | ||
| SMILES | COc1ccccc1-n1nc(OC2CC(C)(C)[S@+]([O-])C(C)(C)C2)cc1-c1ccc(cc1)C#N |r,wU:17.18,(3.06,1.12,;3.46,2.61,;2.37,3.7,;2.77,5.19,;1.68,6.28,;.19,5.88,;-.21,4.39,;.88,3.3,;.48,1.82,;1.39,.57,;.48,-.68,;.88,-2.16,;2.22,-2.93,;2.22,-4.47,;3.55,-5.24,;3.55,-6.78,;2.22,-6.01,;4.88,-4.47,;6.22,-5.24,;4.88,-2.93,;6.42,-2.93,;5.65,-1.6,;3.55,-2.16,;-.98,-.2,;-.98,1.34,;-2.07,2.43,;-1.67,3.92,;-2.76,5,;-4.29,4.65,;-4.65,3.12,;-3.56,2.03,;-5.37,5.73,;-6.46,6.82,)| | ||
| Structure | 
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