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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.35 |
| ▸ | TRPC6 | Q9Y210 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL5978880 | 0.96 | ALDH1A1 (0.38) | ALDH1A1RAB9AMAPTMAPK1ATM | |
| Bromide SCHEMBL6425488 | 0.88 | SMN1; SMN2 (0.36) | ALDH1A1MAPK1KMT2AKDM4ETP53 | |
| Bromide SCHEMBL5015757 | 0.87 | KMT2A (0.44) | ALDH1A1RAB9AMAPTKMT2AKDM4E | |
| SCHEMBL6772875 | 0.81 | ALDH1A1 (0.38) | ALDH1A1RAB9AMAPTMAPK1ATM | |
| Hydrochloric Acid SCHEMBL3848955 | 0.80 | HPGD (0.44) | ALDH1A1RAB9AMAPK1ATMKMT2A | |
| SCHEMBL5071288 | 0.79 | HPGD (0.45) | ALDH1A1RAB9AMAPK1ATMKMT2A | |
| Bromide SCHEMBL7052826 | 0.77 | ALDH1A1 (0.33) | ALDH1A1RAB9AMAPTMAPK1ATM | |
| Hydrochloric Acid SCHEMBL3847184 | 0.77 | HPGD (0.43) | ALDH1A1RAB9AMAPTATMKMT2A | |
| Bromide SCHEMBL8081586 | 0.77 | KMT2A (0.54) | ALDH1A1RAB9AKMT2ALMNANPC1 | |
| Bromide SCHEMBL3843812 | 0.77 | KMT2A (0.54) | ALDH1A1RAB9AKMT2ALMNANPC1 |
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-1128830-A4 | REVERSING ADVANCED GLYCOSYLATION CROSS-LINKS USING HETEROCYCLIC-SUBSTITUTED THIAZOLIUM SALTS | ALTEON INC (US) | 2004-03-31 | — | — | EP | disclosed |
| EP-1128830-A1 | REVERSING ADVANCED GLYCOSYLATION CROSS-LINKS USING HETEROCYCLIC-SUBSTITUTED THIAZOLIUM SALTS | Alteon, Inc. (US) | 2001-09-05 | — | — | EP | disclosed |
| WO-2000027395-A1 | REVERSING ADVANCED GLYCOSYLATION CROSS-LINKS USING HETEROCYCLIC-SUBSTITUTED THIAZOLIUM SALTS | ALTEON, INC. (US) | 2000-05-18 | — | — | WO | disclosed |