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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.69 |
| ▸ | MAOB | P27338 | 5/20 | 0.63 |
| ▸ | IDO1 | P14902 | 2/20 | 0.61 |
| ▸ | HTR2A | P28223 | 1/20 | 0.59 |
| ▸ | HTR2C | P28335 | 1/20 | 0.59 |
| ▸ | HTR2B | P41595 | 1/20 | 0.59 |
| ▸ | ACP3 | P15309 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | MIF | P14174 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | PNMT | P11086 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL31513704 | 1.00 | TAAR1 (0.69) | TAAR1MAOBIDO1HTR2AHTR2C | |
| SCHEMBL29463258 | 0.98 | TAAR1 (0.71) | TAAR1MAOBIDO1HTR2AHTR2C | |
| SCHEMBL39655 | 0.98 | TAAR1 (0.71) | TAAR1MAOBIDO1HTR2AHTR2C | |
| Iodide SCHEMBL11221836 | 0.96 | TAAR1 (0.69) | TAAR1MAOBIDO1HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL26616857 | 0.96 | TAAR1 (0.69) | TAAR1MAOBIDO1HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL11220775 | 0.96 | TAAR1 (0.69) | TAAR1MAOBIDO1HTR2AHTR2C | |
| Ethylamine SCHEMBL4238530 | 0.92 | TAAR1 (0.65) | TAAR1MAOBIDO1HTR2AHTR2C | |
| SCHEMBL8107790 | 0.87 | TAAR1 (0.59) | TAAR1MAOBIDO1HTR2AHTR2C | |
| SCHEMBL3727416 | 0.86 | MAOB (0.61) | TAAR1MAOBIDO1HTR2AHTR2C | |
| Acetic Acid SCHEMBL29007023 | 0.86 | TAAR1 (0.57) | TAAR1MAOBIDO1HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| US-4343647-A | Substituted benzyltrialkylammonium salts and their use as plant growth regulatory control agents | THE DOW CHEMICAL COMPANY (US) | 1982-08-10 | — | — | US | disclosed |