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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 known ✓ | P35372 | 1/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CETP | P11597 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | UBE2N | P61088 | 1/20 | 0.42 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9575716 | 0.98 | SPHK1 (0.52) | SPHK1LMNAOPRM1CYP2D6TP53 | |
| SCHEMBL9575908 | 0.98 | SPHK1 (0.52) | SPHK1LMNAOPRM1CYP2D6TP53 | |
| Hydrochloric Acid SCHEMBL9575910 | 0.95 | SPHK1 (0.50) | SPHK1LMNAOPRM1CYP2D6TP53 | |
| Hydrochloric Acid SCHEMBL9794770 | 0.95 | SPHK1 (0.50) | SPHK1LMNAOPRM1CYP2D6TP53 | |
| Hydrochloric Acid SCHEMBL2059996 | 0.95 | SPHK1 (0.50) | SPHK1LMNAOPRM1CYP2D6TP53 | |
| Water SCHEMBL11079489 | 0.95 | SPHK1 (0.50) | SPHK1LMNAOPRM1CYP2D6TP53 | |
| Bromide SCHEMBL9575619 | 0.88 | FAAH (0.44) | LMNATP53CYP3A4GMNNPOLB | |
| Hydrochloric Acid SCHEMBL9575611 | 0.84 | FAAH (0.44) | LMNATP53CYP3A4GMNNPOLB | |
| Bromide SCHEMBL3792437 | 0.84 | SPHK1 (0.43) | SPHK1LMNAOPRM1DNM1ACE2 | |
| Bromide SCHEMBL9575764 | 0.84 | SPHK1 (0.43) | SPHK1LMNAOPRM1DNM1ACE2 |
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-0371406-B1 | OXYALKYLATED QUATERNARY AMMONIUM COMPOUNDS, PROCESSES FOR PRODUCTION THEREOF, AND PLANT GROWTH REGULATING COMPOSITIONS CONTAINING SAID COMPOUNDS | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 1993-08-04 | — | — | EP | disclosed |
| US-5076828-A | Immersing seeds into quaternary solution prior to planting | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 1991-12-31 | — | — | US | disclosed |