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 | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | RXRG | P48443 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | CDK4 | P11802 | 1/20 | 0.30 |
| ▸ | CCND1 | P24385 | 1/20 | 0.30 |
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 SCHEMBL9308701 | 0.88 | GABRB3 (0.38) | KDM4EALDH1A1 | |
| SCHEMBL9309547 | 0.78 | MAPK1 (0.38) | RXRARXRBRXRGMAPK1KDM4E | |
| Bromide SCHEMBL9309032 | 0.76 | KDM4E (0.41) | KDM4EMEN1ALDH1A1POLBMAPT | |
| SCHEMBL10682964 | 0.72 | MAPK1 (0.42) | RXRARXRBRXRGMAPK1KDM4E | |
| SCHEMBL9309033 | 0.70 | MAPK1 (0.54) | RXRARXRBRXRGMAPK1KDM4E | |
| SCHEMBL7961959 | 0.70 | KMT2A (0.49) | RXRARXRBRXRGMAPK1KDM4E | |
| SCHEMBL9309697 | 0.67 | MAPK1 (0.40) | RXRARXRBRXRGMAPK1KDM4E | |
| Methane SCHEMBL10739351 | 0.66 | MAPK1 (0.37) | RXRARXRBRXRGMAPK1KDM4E | |
| SCHEMBL10848269 | 0.66 | MAPK1 (0.40) | RXRARXRBRXRGMAPK1L3MBTL1 | |
| SCHEMBL10739344 | 0.65 | MAPK1 (0.39) | RXRARXRBRXRGMAPK1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5321002-A | Herbicidal derivatives of 2-(1-aryl-4-cyano-5-pyrazolylmethyleneiminooxy)alkanoic acids | FMC CORPORATION (US) | 1994-06-14 | — | — | US | disclosed |