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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | RXRB | P28702 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 SCHEMBL27692975 | 0.84 | KMT2A (0.53) | TP53CYP3A4KDM4ELTA4HMAPK1 | |
| 1,3-Diethoxybenzene SCHEMBL1100167 | 0.82 | TP53 (0.71) | TP53CYP3A4KDM4EALDH1A1SMN1; SMN2 | |
| Bromide SCHEMBL21796147 | 0.80 | MAOB (0.37) | TP53CYP3A4MAPK1CYP1A2CYP2D6 | |
| SCHEMBL910172 | 0.76 | TP53 (0.53) | TP53CYP3A4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL29426410 | 0.76 | RXRA (0.66) | TP53CYP3A4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL1204104 | 0.76 | TP53 (0.63) | TP53CYP3A4KDM4EALDH1A1SMN1; SMN2 | |
| Bromide SCHEMBL27655199 | 0.76 | ACHE (0.54) | CYP3A4ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL9488001 | 0.76 | TP53 (0.63) | TP53CYP3A4KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL9260410 | 0.76 | RXRA (0.66) | TP53CYP3A4KDM4EALDH1A1SMN1; SMN2 | |
| Bromide SCHEMBL27810353 | 0.75 | MAOB (0.61) | KDM4EALDH1A1MAPTGAATHRB |
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-102050837-A | Method for synthesizing tri(m-ethoxyphenyl)bismuthine | YUJIE JI | 2011-05-11 | — | — | CN | disclosed |