Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10697466 | 0.93 | ALDH1A1 (0.33) | ALDH1A1MAPTHSD17B10POLBGAA | |
| SCHEMBL28136703 | 0.63 | MGLL (0.37) | ALDH1A1MEN1KMT2AGAA | |
| SCHEMBL11103522 | 0.63 | ALDH1A1 (0.47) | ALDH1A1MAPTHSD17B10MEN1RAB9A | |
| Hydrochloric Acid SCHEMBL31396653 | 0.61 | ALDH1A1 (0.46) | ALDH1A1MAPTHSD17B10MEN1RAB9A | |
| SCHEMBL31379747 | 0.61 | ALDH1A1 (0.46) | ALDH1A1MAPTHSD17B10MEN1RAB9A | |
| Hydrochloric Acid SCHEMBL8777085 | 0.60 | — | — | |
| SCHEMBL13651426 | 0.60 | NPSR1 (0.44) | ALDH1A1MAPTHSD17B10MEN1RAB9A | |
| SCHEMBL11575842 | 0.60 | MEN1 (0.42) | ALDH1A1MAPTMEN1RAB9AKMT2A | |
| SCHEMBL31550440 | 0.59 | GSK3A (0.40) | ALDH1A1MAPTHSD17B10RAB9APOLB | |
| SCHEMBL9945739 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1051547-C | Beta-lactams derivative and its prep. and use | HOFFMANN LA ROCHE (CH) | 2000-04-19 | — | — | CN | disclosed |
| CN-1132752-A | Beta-lactam derivatives, process for their preparation and their use | HOFFMANN LA ROCHE (CH) | 1996-10-09 | — | — | CN | disclosed |