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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL3406159 | 0.88 | — | — | |
| Bromide SCHEMBL18203179 | 0.85 | ALDH1A1 (0.39) | MEN1KMT2AKDM4EALDH1A1HPGD | |
| Bromide SCHEMBL3402591 | 0.84 | KDM4E (0.40) | MEN1KMT2AKDM4E | |
| Bromide SCHEMBL3406156 | 0.84 | KDM4E (0.40) | MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL12639201 | 0.83 | ALDH1A1 (0.40) | MEN1KMT2AKDM4EPABPC1ALDH1A1 | |
| SCHEMBL5284684 | 0.81 | MEN1 (0.43) | MEN1KMT2AKDM4EPABPC1ALDH1A1 | |
| Bromide SCHEMBL3408299 | 0.81 | CYP1A2 (0.41) | MEN1KMT2AKDM4EALDH1A1PKM | |
| Bromide SCHEMBL15992936 | 0.80 | NQO1 (0.41) | ALDH1A1 | |
| SCHEMBL12639196 | 0.78 | NQO1 (0.42) | KMT2AALDH1A1 | |
| Bromide SCHEMBL1886752 | 0.78 | MEN1 (0.56) | MEN1KMT2APABPC1ALDH1A1 |
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-2254871-A1 | SALTS COMPRISING ARYL-ALKYL-SUBSTITUTED IMIDAZOLIUM AND TRIAZOLIUM CATIONS AS IONIC FLUIDS | Technische Universität Dresden (DE) | 2010-12-01 | — | — | EP | disclosed |
| WO-2009095012-A1 | SALTS COMPRISING ARYL-ALKYL-SUBSTITUTED IMIDAZOLIUM AND TRIAZOLIUM CATIONS AND THE USE THEREOF | Technische Universität Dresden (DE) | 2009-08-06 | — | — | WO | disclosed |