Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | DNM1 | Q05193 | 10/20 | 0.56 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
| ▸ | RAD52 | P43351 | 1/20 | 0.54 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
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 SCHEMBL27973093 | 1.00 | ALDH1A1 (0.57) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| Bromide SCHEMBL556740 | 1.00 | ALDH1A1 (0.57) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| Bromide SCHEMBL28011619 | 1.00 | ALDH1A1 (0.57) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| Bromide SCHEMBL28088878 | 1.00 | ALDH1A1 (0.57) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| SCHEMBL6727148 | 0.97 | SLC22A1 (0.55) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| SCHEMBL3802276 | 0.97 | SLC22A1 (0.55) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| SCHEMBL8558471 | 0.97 | SLC22A1 (0.55) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| SCHEMBL9575954 | 0.97 | SLC22A1 (0.55) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| SCHEMBL11034134 | 0.97 | SLC22A1 (0.55) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| SCHEMBL10820897 | 0.97 | SLC22A1 (0.55) | ALDH1A1TP53CYP3A4ALOX15TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111118656-B | ES fiber containing wormwood extract and preparation method thereof | 百事基材料（青岛）股份有限公司 | 2021-05-18 | — | — | CN | claimed |
| EP-0371406-B1 | OXYALKYLATED QUATERNARY AMMONIUM COMPOUNDS, PROCESSES FOR PRODUCTION THEREOF, AND PLANT GROWTH REGULATING COMPOSITIONS CONTAINING SAID COMPOUNDS | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 1993-08-04 | — | — | EP | disclosed |
| US-5076828-A | Immersing seeds into quaternary solution prior to planting | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 1991-12-31 | — | — | US | disclosed |