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 | |
|---|---|---|---|---|
| ▸ | OPRM1 known ✓ | P35372 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | SLC6A9 | P48067 | 9/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SCD | O00767 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | PARG | Q86W56 | 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 SCHEMBL7619352 | 1.00 | HTT (0.45) | HTTALDH1A1OPRM1OPRL1ATM | |
| Bromide SCHEMBL8900703 | 0.76 | KMT2A (0.38) | ALDH1A1HRH3L3MBTL1KMT2AHSD17B10 | |
| Bromide SCHEMBL8558814 | 0.76 | KMT2A (0.38) | ALDH1A1HRH3L3MBTL1KMT2AHSD17B10 | |
| Bromide SCHEMBL7614674 | 0.75 | L3MBTL1 (0.46) | ALDH1A1PKML3MBTL1SCDHSD17B10 | |
| Bromide SCHEMBL7614677 | 0.75 | L3MBTL1 (0.46) | ALDH1A1PKML3MBTL1SCDHSD17B10 | |
| Bromide SCHEMBL8564796 | 0.74 | ALDH1A1 (0.36) | HTTALDH1A1KMT2ALMNATSHR | |
| Bromide SCHEMBL8564801 | 0.74 | ALDH1A1 (0.36) | HTTALDH1A1KMT2ALMNATSHR | |
| Bromide SCHEMBL7880295 | 0.73 | MEN1 (0.43) | MEN1KMT2A | |
| Bromide SCHEMBL7880298 | 0.73 | MEN1 (0.43) | MEN1KMT2A | |
| SCHEMBL8788663 | 0.72 | LCAT (0.40) | HTTALDH1A1OPRM1OPRL1ATM |
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-0620225-B1 | Cephalosporin derivatives | BASILEA PHARMACEUTICA AG (CH) | 2002-11-13 | — | — | EP | disclosed |
| US-5523400-A | 3-(PYRROLIDIN-3-YLIDENE=CH-),7-((2-AMINOTHIAZOL-4-YL)HYDROX -IMINOACETYLAMINO-)-3-CEPHEM DERIVATIVES; BROAD SPECTRUM ANTIBIOTICS | HOFFMANN-LA ROCHE INC. (US) | 1996-06-04 | — | — | US | disclosed |
| EP-0620225-A1 | Cephalosporin derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1994-10-19 | — | — | EP | disclosed |