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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL4509169 | 0.90 | ALDH1A1 (0.48) | ALDH1A1GAASLC6A3KMT2AMEN1 | |
| Bromide SCHEMBL11599708 | 0.85 | KDM4E (0.49) | ALDH1A1GAAKMT2AMEN1KDM4E | |
| Bromide SCHEMBL17714307 | 0.84 | ABL1 (0.48) | ALDH1A1GAASLC6A3KMT2AMEN1 | |
| Bromide SCHEMBL17714327 | 0.84 | PLA2G2A (0.46) | ALDH1A1SLC6A3KDM4ESMN1; SMN2LMNA | |
| Bromide SCHEMBL3558232 | 0.83 | ALDH1A1 (0.53) | ALDH1A1SLC6A3KMT2AKDM4ELMNA | |
| Bromide SCHEMBL31123663 | 0.80 | DPP4 (0.42) | ALDH1A1GAASLC6A3KMT2AKDM4E | |
| Bromide SCHEMBL29627822 | 0.80 | PTGDR2 (0.44) | ALDH1A1SLC6A3KMT2AKDM4ELMNA | |
| SCHEMBL29627816 | 0.78 | PTGDR2 (0.45) | ALDH1A1SLC6A3KMT2AKDM4ELMNA | |
| SCHEMBL4468280 | 0.77 | NR4A2 (0.46) | ALDH1A1GAASLC6A3KDM4EL3MBTL1 | |
| SCHEMBL3712715 | 0.77 | NR4A2 (0.50) | ALDH1A1GAASLC6A3KMT2AMEN1 |
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-0984963-B1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2001-04-11 | — | — | EP | disclosed |
| US-6162808-A | Compounds | ASTRAZENECA U.K. LIMITED (GB) | 2000-12-19 | — | — | US | disclosed |
| EP-0984963-A1 | NOVEL COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 2000-03-15 | — | — | EP | disclosed |
| WO-1998054180-A1 | NOVEL COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1998-12-03 | — | — | WO | disclosed |