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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MITF | O75030 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL30241688 | 0.89 | MEN1 (0.56) | MEN1KMT2ATDP1NPC1RAB9A | |
| SCHEMBL14980604 | 0.78 | — | — | |
| Bromide SCHEMBL30020235 | 0.75 | NPC1 (0.58) | MEN1KMT2ATDP1NPC1RAB9A | |
| Bromide SCHEMBL30021026 | 0.75 | NPC1 (0.58) | MEN1KMT2ATDP1NPC1RAB9A | |
| Bromide SCHEMBL31435799 | 0.75 | NPC1 (0.58) | MEN1KMT2ATDP1NPC1RAB9A | |
| Bromide SCHEMBL29786703 | 0.75 | NPC1 (0.58) | MEN1KMT2ATDP1NPC1RAB9A | |
| Bromide SCHEMBL29463912 | 0.75 | NPC1 (0.58) | MEN1KMT2ATDP1NPC1RAB9A | |
| SCHEMBL16649164 | 0.73 | MEN1 (0.62) | MEN1KMT2ATDP1NPC1RAB9A | |
| SCHEMBL30488665 | 0.72 | NPC1 (0.33) | MEN1KMT2ATDP1NPC1RAB9A | |
| SCHEMBL24938735 | 0.71 | NPC1 (0.60) | MEN1KMT2ATDP1NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113461938-B | Carbon dioxide-based ionic polyurea and preparation method and application thereof | 东华大学 | 2022-05-20 | — | — | CN | disclosed |