Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.38 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | PDCD1LG2 | Q9BQ51 | 2/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30172379 | 0.98 | KCNA5 (0.44) | KCNA5KCNH2SCN8ACYP11B1CYP11B2 | |
| Maleic Acid SCHEMBL30172359 | 0.86 | EPHX1 (0.41) | KCNA5KCNH2GAASLC6A2EPHX1 | |
| Fumaric Acid SCHEMBL30172465 | 0.86 | EPHX1 (0.41) | KCNA5KCNH2GAASLC6A2EPHX1 | |
| SCHEMBL10449365 | 0.84 | TACR1 (0.51) | SCN8ACYP11B1CYP11B2TACR1GAA | |
| SCHEMBL22910534 | 0.81 | LTA4H (0.53) | KCNA5KCNH2CYP11B1CYP11B2SLC6A2 | |
| SCHEMBL9289991 | 0.78 | KCNA5 (0.50) | KCNA5KCNH2CYP11B1CYP11B2NOTUM | |
| SCHEMBL23330752 | 0.77 | KCNA5 (0.47) | KCNA5KCNH2CYP11B1CYP11B2GPBAR1 | |
| SCHEMBL24352255 | 0.76 | CASP6 (0.41) | GAAPDCD1LG2CD274CYP2D6TSHR | |
| SCHEMBL24352211 | 0.76 | CASP6 (0.49) | SCN8AGAASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL23346997 | 0.73 | KDM4E (0.42) | GAAPDCD1LG2CD274CYP2D6HIF1A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115677675-A | Salt of 6-oxaspiro [4,5] decane compound, preparation method and application | 成都苑东生物制药股份有限公司 | 2023-02-03 | — | — | CN | disclosed |