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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MITF | O75030 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL687509 | 0.97 | NPC1 (0.41) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| SCHEMBL2860360 | 0.97 | NPC1 (0.41) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| Water SCHEMBL28473400 | 0.94 | NPC1 (0.40) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| Fluoride Ion SCHEMBL29252169 | 0.94 | NPC1 (0.40) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| Hydrochloric Acid SCHEMBL29252318 | 0.94 | NPC1 (0.40) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| Iodide SCHEMBL8780637 | 0.94 | NPC1 (0.40) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| Iodide SCHEMBL8780643 | 0.94 | NPC1 (0.40) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| Iodide SCHEMBL8953649 | 0.94 | NPC1 (0.40) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| Iodide SCHEMBL8953645 | 0.94 | NPC1 (0.40) | NPC1RAB9AL3MBTL1CTDSP1KDM4E | |
| SCHEMBL898705 | 0.94 | NPC1 (0.38) | NPC1RAB9AL3MBTL1CTDSP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0628585-B1 | Advancement catalyst containing epoxy resin compositions | CIBA GEIGY (CH) | 1997-06-04 | — | — | EP | disclosed |
| US-5521261-A | PERHYDROAZEPINIUM OR OCTAHYDROAZOCINIUM SALT FOR CHAIN EXTENSION | CIBA-GEIGY CORPORATION (US) | 1996-05-28 | — | — | US | disclosed |
| EP-0628585-A2 | Advancement catalyst containing epoxy resin compositions | CIBA-GEIGY AG (CH) | 1994-12-14 | — | — | EP | disclosed |