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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.33 |
| ▸ | BBOX1 | O75936 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 SCHEMBL22034579 | 0.82 | BBOX1 (0.48) | BBOX1HTTSMN1; SMN2LMNARAB9A | |
| SCHEMBL19762857 | 0.79 | BBOX1 (0.47) | BBOX1HTTSMN1; SMN2LMNARAB9A | |
| SCHEMBL19762863 | 0.77 | BBOX1 (0.46) | BBOX1HTTSMN1; SMN2LMNARAB9A | |
| SCHEMBL19762860 | 0.77 | BBOX1 (0.60) | BBOX1HTTSMN1; SMN2LMNARAB9A | |
| Bromide SCHEMBL23877787 | 0.77 | HTT (0.51) | BBOX1HTTSMN1; SMN2LMNARAB9A | |
| SCHEMBL14882682 | 0.76 | BBOX1 (0.35) | BBOX1ACHE | |
| Bromide SCHEMBL23877775 | 0.75 | BBOX1 (0.41) | BBOX1HTTSMN1; SMN2LMNARAB9A | |
| SCHEMBL22082569 | 0.74 | BBOX1 (0.38) | BBOX1HTTSMN1; SMN2LMNARAB9A | |
| Bromide SCHEMBL22034562 | 0.74 | SMN1; SMN2 (0.54) | BBOX1HTTSMN1; SMN2LMNARAB9A | |
| SCHEMBL19762880 | 0.74 | HTT (0.49) | BBOX1HTTSMN1; SMN2LMNARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3891751-A1 | QUATERNARY AMMONIUM SALTS AS INHIBITORS OF TRIMETHYLAMINE PRODUCTION | Senda Biosciences, Inc. (US) | 2021-10-13 | — | — | EP | disclosed |
| WO-2020118238-A1 | QUATERNARY AMMONIUM SALTS AS INHIBITORS OF TRIMETHYLAMINE PRODUCTION | KINTAI THERAPEUTICS, INC. (US) | 2020-06-11 | — | — | WO | disclosed |