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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 8/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.48 |
| ▸ | ABL1 | P00519 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3599077 | 0.99 | SIRT5 (0.58) | SIRT5MEN1KMT2AABL1RAB9A | |
| Bromide SCHEMBL11244045 | 0.91 | ABL1 (0.50) | SIRT5MEN1KMT2AABL1RAB9A | |
| SCHEMBL3610837 | 0.83 | ABL1 (0.56) | MEN1KMT2AABL1RAB9ALMNA | |
| SCHEMBL3609158 | 0.83 | MEN1 (0.52) | MEN1KMT2AABL1RAB9ANPC1 | |
| SCHEMBL3593375 | 0.81 | MEN1 (0.57) | MEN1KMT2AABL1RAB9ANPC1 | |
| SCHEMBL3613551 | 0.80 | RAB9A (0.70) | MEN1KMT2ARAB9ANPC1LMNA | |
| Bromide SCHEMBL7146574 | 0.80 | KMT2A (0.68) | MEN1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL3593035 | 0.78 | CSNK2A1 (0.67) | MEN1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL3605683 | 0.78 | HDAC3 (0.61) | MEN1KMT2ANPC1LMNAMAPT | |
| SCHEMBL3610888 | 0.77 | ABL1 (0.54) | MEN1KMT2AABL1RAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4315009-A | Antisecretory guanidine derivatives and pharmaceutical compositions containing them | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1982-02-09 | — | — | US | disclosed |
| EP-0003640-A2 | Antisecretory guanidine derivatives, processes for their manufacture and pharmaceutical compositions containing them | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1979-08-22 | — | — | EP | disclosed |