Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | AMPD2 | Q01433 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27836159 | 0.88 | LMNA (0.36) | LMNATSHRSMN1; SMN2BRD4CYP2D6 | |
| SCHEMBL27854293 | 0.88 | TSHR (0.39) | LMNATSHRSMN1; SMN2BRD4CYP2D6 | |
| SCHEMBL27791901 | 0.86 | GSK3A (0.37) | LMNATSHRSMN1; SMN2CYP2D6GSK3A | |
| Bromide SCHEMBL29099290 | 0.85 | MAPT (0.41) | LMNASMN1; SMN2ALDH1A1 | |
| Bromide SCHEMBL28311088 | 0.84 | ALDH1A1 (0.42) | LMNATSHRSMN1; SMN2CYP2D6ALDH1A1 | |
| SCHEMBL5969762 | 0.84 | ADRA1D (0.38) | TSHRCYP2D6AMPD2ALDH1A1 | |
| SCHEMBL16385837 | 0.82 | ALDH1A1 (0.43) | LMNATSHRSMN1; SMN2CYP2D6ALDH1A1 | |
| SCHEMBL10619250 | 0.80 | SIGMAR1 (0.36) | GSK3AGSK3BMGLLALDH1A1 | |
| Bromide SCHEMBL27836142 | 0.78 | — | — | |
| Bromide SCHEMBL27466671 | 0.76 | LMNA (0.40) | LMNATSHRSMN1; SMN2GSK3AGSK3B |
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-102014854-A | Bleaching agent having cationic acyl pyridinium derivatives, co-bleaching activators, and hydrogen peroxide | HENKEL AG & CO KGAA | 2011-04-13 | — | — | CN | disclosed |