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 | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.42 |
| ▸ | CA9 | Q16790 | 6/20 | 0.42 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.40 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.40 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | UGT1A7 | Q9HAW7 | 1/20 | 0.40 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26313780 | 0.82 | TP53 (0.47) | CA12CA9CA1TP53CA2 | |
| SCHEMBL26313777 | 0.80 | TP53 (0.45) | CA12CA9CA1TP53CA2 | |
| SCHEMBL26313819 | 0.75 | CA9 (0.45) | CA12CA9CA1CA2RAB9A | |
| SCHEMBL26313789 | 0.75 | MMP2 (0.40) | TP53GAA | |
| SCHEMBL26313790 | 0.74 | CA12 (0.41) | CA12CA9TP53CA2RAB9A | |
| SCHEMBL26313787 | 0.74 | TP53 (0.43) | CA12CA9TP53CA2RAB9A | |
| Hydrochloric Acid SCHEMBL30321030 | 0.74 | TP53 (0.42) | CA12CA9TP53CA2RAB9A | |
| SCHEMBL26313795 | 0.68 | TP53 (0.43) | CA12CA9CA1TP53CA2 | |
| SCHEMBL2057514 | 0.68 | CA9 (0.66) | CA12CA9CA1CA2RAB9A | |
| SCHEMBL25412881 | 0.66 | LMNA (0.38) | CA12CA9CA1TP53CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115989219-A | Probenecid compounds for the treatment of inflammasome-mediated pulmonary diseases | 贝凯恩生物医疗技术有限公司 | 2023-04-18 | — | — | CN | disclosed |