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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 4/20 | 0.61 |
| ▸ | CA2 | P00918 | 5/20 | 0.57 |
| ▸ | CA1 | P00915 | 4/20 | 0.57 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA7 | P43166 | 2/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 4/20 | 0.44 |
| ▸ | ADH1B | P00325 | 1/20 | 0.44 |
| ▸ | ADH1C | P00326 | 1/20 | 0.44 |
| ▸ | ADH1A | P07327 | 1/20 | 0.44 |
| ▸ | ADH4 | P08319 | 1/20 | 0.44 |
| ▸ | ADH7 | P40394 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1704321 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL1679669 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL2694822 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL10312301 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL1703464 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL11335730 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL5696662 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL11326328 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL5020900 | 0.98 | PPARA (0.64) | PPARACA2CA1EPHX1CA12 | |
| SCHEMBL327308 | 0.95 | PPARA (0.60) | PPARACA2CA1EPHX1CA12 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3518692-A1 | VAPORIZABLE TOBACCO WAX COMPOSITIONS AND CONTAINER THEREOF | Bond Street Manufacturing LLC (US) | 2019-08-07 | — | — | EP | disclosed |
| WO-2018064032-A1 | VAPORIZABLE TOBACCO WAX COMPOSITIONS AND CONTAINER THEREOF | BOND STREET MANUFACTURING LLC (US) | 2018-04-05 | — | — | WO | disclosed |
| EP-1709100-A1 | COMPOSITIONS USEFUL AS COATINGS, THEIR PREPARATION, AND ARTICLES MADE THEREFROM | GENERAL ELECTRIC COMPANY (US) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005073271-A1 | COMPOSITIONS USEFUL AS COATINGS, THEIR PREPARATION, AND ARTICLES MADE THEREFROM | GENERAL ELECTRIC COMPANY (US) | 2005-08-11 | — | — | WO | disclosed |