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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB8 | P28062 | 4/20 | 0.50 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.49 |
| ▸ | SNCA | P37840 | 2/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 2/20 | 0.30 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.30 |
| ▸ | TLR4 | O00206 | 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 | |
|---|---|---|---|---|
| SCHEMBL9757041 | 0.75 | PSMB8 (0.59) | PSMB8PSMB5LMNATP53SMN1; SMN2 | |
| Bromide SCHEMBL9376893 | 0.74 | SNCA (0.34) | SNCACYP3A4LMNATP53 | |
| Bromide SCHEMBL9636844 | 0.70 | SNCA (0.37) | SNCAXDH | |
| Bromide SCHEMBL7386874 | 0.70 | SNCA (0.44) | SNCA | |
| Bromide SCHEMBL7388733 | 0.69 | SNCA (0.43) | SNCA | |
| SCHEMBL548913 | 0.69 | PSMB8 (1.00) | PSMB8PSMB5ALDH1A1LMNATP53 | |
| Bromide SCHEMBL7341008 | 0.68 | SNCA (0.56) | SNCASMN1; SMN2 | |
| Bromide SCHEMBL1532727 | 0.67 | FOLH1 (0.48) | SNCAALDH1A1LMNA | |
| Bromide SCHEMBL6260188 | 0.67 | ALDH1A1 (0.49) | SNCAALDH1A1CYP3A4LMNASMN1; SMN2 | |
| Bromide SCHEMBL31753766 | 0.67 | TRPV4 (0.45) | SNCA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991019475-A2 | QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1991-12-26 | — | — | WO | disclosed |
| US-5041453-A | Quinolinyl-benzoheterobicyclic derivatives as antagonists of leukotriene D4 | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1991-08-20 | — | — | US | disclosed |