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 | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | IGF1R | P08069 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | APAF1 | O14727 | 1/20 | 0.38 |
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 SCHEMBL9661590 | 0.95 | CA1 (0.45) | MEN1KMT2ASMN1; SMN2HSP90AA1CA1 | |
| Bromide SCHEMBL9663315 | 0.95 | MEN1 (0.40) | MEN1KMT2ASMN1; SMN2SIGMAR1HSP90AA1 | |
| Bromide SCHEMBL9661598 | 0.93 | MEN1 (0.47) | MEN1KMT2ASMN1; SMN2HSP90AA1CA1 | |
| Bromide SCHEMBL9663744 | 0.92 | MEN1 (0.46) | MEN1KMT2ASMN1; SMN2HSP90AA1IGF1R | |
| Bromide SCHEMBL9663747 | 0.92 | MEN1 (0.46) | MEN1KMT2ASMN1; SMN2HSP90AA1IGF1R | |
| Bromide SCHEMBL9661615 | 0.80 | CALM1 (0.44) | SIGMAR1CALM1IGF1RALOX15HRH3 | |
| Bromide SCHEMBL9661601 | 0.80 | MAPT (0.49) | MEN1KMT2ASMN1; SMN2SIGMAR1HSP90AA1 | |
| Bromide SCHEMBL9663297 | 0.80 | CA1 (0.46) | MEN1KMT2ASMN1; SMN2HSP90AA1CA1 | |
| Bromide SCHEMBL556687 | 0.78 | MEN1 (0.55) | MEN1KMT2ASMN1; SMN2HSP90AA1MAPT | |
| Bromide SCHEMBL17926156 | 0.78 | MEN1 (0.55) | MEN1KMT2ASMN1; SMN2HSP90AA1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0131302-B1 | IMIDAZOLIUM SALTS, INTERMEDIATES THERETO AND THEIR USE | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-01-29 | — | — | EP | disclosed |
| US-4689341-A | Antiarrhythmic imidazoles | SCHERING A.G. (DE) | 1987-08-25 | — | — | US | disclosed |
| US-4613609-A | Antiarrhythmic imidazoliums | SCHERING A. G. (DE) | 1986-09-23 | — | — | US | disclosed |
| US-4581370-A | Antiarrhythmic imidazoliums | SCHERING A.G. (DE) | 1986-04-08 | — | — | US | disclosed |