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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 4/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 SCHEMBL5354634 | 0.87 | — | — | |
| SCHEMBL6596119 | 0.86 | ALDH1A1 (0.30) | MAPTKMT2AALDH1A1LMNAL3MBTL1 | |
| Bromide SCHEMBL5437693 | 0.85 | — | — | |
| SCHEMBL6598001 | 0.81 | ALDH1A1 (0.38) | MAPTKMT2AALDH1A1LMNAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL6596513 | 0.79 | RAB9A (0.43) | MAPTKMT2AALDH1A1LMNAHPGD | |
| Hydrochloric Acid SCHEMBL5363423 | 0.78 | ALDH1A1 (0.36) | MAPTKMT2AALDH1A1LMNAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL3686641 | 0.78 | ALDH1A1 (0.38) | MAPTKMT2AALDH1A1LMNAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL6611866 | 0.75 | POLB (0.38) | MAPTKMT2AALDH1A1LMNAHPGD | |
| SCHEMBL6599925 | 0.71 | KMT2A (0.42) | MAPTKMT2AALDH1A1LMNAHPGD | |
| Hydrochloric Acid SCHEMBL6609904 | 0.71 | POLB (0.34) | MAPTKMT2AALDH1A1LMNAL3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002085897-A9 | HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS | SANKARANARAYANAN ALANGUDI (IN) | 2004-04-01 | — | — | WO | disclosed |