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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.45 |
| ▸ | ADH1B | P00325 | 1/20 | 0.45 |
| ▸ | ADH1C | P00326 | 1/20 | 0.45 |
| ▸ | ADH1A | P07327 | 1/20 | 0.45 |
| ▸ | ADH4 | P08319 | 1/20 | 0.45 |
| ▸ | ADH7 | P40394 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 3/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.41 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.41 |
| ▸ | GBA1 | P04062 | 5/20 | 0.39 |
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 SCHEMBL28882145 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| Bromide SCHEMBL28486310 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| Bromide SCHEMBL28414953 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| SCHEMBL28336030 | 0.98 | ALDH1A1 (0.50) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| Hydrochloric Acid SCHEMBL31087729 | 0.96 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| Hydrochloric Acid SCHEMBL31087714 | 0.96 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| Hydrochloric Acid SCHEMBL31087721 | 0.96 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| Hydrochloric Acid SCHEMBL17200384 | 0.96 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| Hydrochloric Acid SCHEMBL31087712 | 0.96 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C | |
| Hydrochloric Acid SCHEMBL29161814 | 0.96 | ALDH1A1 (0.48) | ALDH1A1TSHREPHX1ADH1BADH1C |
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 |
|---|---|---|---|---|---|---|---|
| CN-109097010-B | High-temperature-resistant high-density reversible water-in-oil/oil-in-water drilling fluid and preparation method thereof | 西南石油大学 | 2021-03-02 | — | — | CN | disclosed |
| CN-107236532-B | Clean fracturing fluid and preparation method thereof | 四川银宇化工科技有限公司 | 2020-11-24 | — | — | CN | disclosed |