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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | APAF1 | O14727 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 2/20 | 0.37 |
| ▸ | PON1 | P27169 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6155544 | 0.98 | — | — | |
| Iodide SCHEMBL22034785 | 0.96 | SMN1; SMN2 (0.43) | SMN1; SMN2MEN1APAF1NPC1PLA2G1B | |
| Hydrochloric Acid SCHEMBL17580242 | 0.96 | SMN1; SMN2 (0.43) | SMN1; SMN2MEN1APAF1NPC1PLA2G1B | |
| SCHEMBL28740218 | 0.90 | SMN1; SMN2 (0.40) | SMN1; SMN2MEN1APAF1NPC1PLA2G1B | |
| Bromide SCHEMBL3854362 | 0.79 | SMN1; SMN2 (0.47) | SMN1; SMN2MEN1APAF1NPC1PLA2G1B | |
| Bromide SCHEMBL2510948 | 0.78 | SMN1; SMN2 (0.46) | SMN1; SMN2MEN1APAF1NPC1PLA2G1B | |
| SCHEMBL15229909 | 0.77 | FDPS (0.43) | SMN1; SMN2MEN1APAF1NPC1PLA2G1B | |
| SCHEMBL6155024 | 0.77 | — | — | |
| SCHEMBL372630 | 0.77 | — | — | |
| Bromide SCHEMBL2512305 | 0.76 | SMN1; SMN2 (0.49) | SMN1; SMN2MEN1APAF1NPC1PLA2G1B |
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 |
|---|---|---|---|---|---|---|---|
| CN-118085311-A | Kilogram-level preparation method of metal cluster-based energetic MOFs | 郑州大学 | 2024-05-28 | — | — | CN | claimed |
| CN-118085311-A | Kilogram-level preparation method of metal cluster-based energetic MOFs | 郑州大学 | 2024-05-28 | — | — | CN | disclosed |
| CN-114395432-B | Method for in-situ preparation of triazole lubricating oil additive based on friction-click chemistry | 中国科学院兰州化学物理研究所 | 2022-06-10 | — | — | CN | disclosed |
| CN-114395432-A | Method for in-situ preparation of triazole lubricating oil additive based on friction-click chemistry | 中国科学院兰州化学物理研究所 | 2022-04-26 | — | — | CN | disclosed |