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 | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.65 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.59 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.59 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.59 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.80 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.71 |
| ▸ | STAT6 | P42226 | 1/20 | 0.71 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.69 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.69 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.68 |
| ▸ | GFER | P55789 | 1/20 | 0.68 |
| ▸ | HTR2A | P28223 | 1/20 | 0.65 |
| ▸ | HTR7 | P34969 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL6141647 | 0.98 | CYP1A2 (0.83) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL19614388 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL2208304 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL11590344 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL7401382 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL15501213 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL30423175 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL11299646 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL11339285 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL12371907 | 0.91 | CYP1A2 (0.71) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7358313-B2 | Thiouronium salt as anti-reversion agent in a vulcanizable rubber composition and tire based on such a composition | MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) | 2008-04-15 | — | — | US | disclosed |
| US-20050187340-A1 | Thiouronium salt as anti-reversion agent in a vulcanizable rubber composition and tire based on such a composition | MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) | 2005-08-25 | — | — | US | disclosed |