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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 3/20 | 0.50 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.46 |
| ▸ | ESR1 | P03372 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29405862 | 0.94 | — | — | |
| SCHEMBL125704 | 0.94 | — | — | |
| SCHEMBL27455088 | 0.92 | ACHE (0.52) | ACHEHTTSMN1; SMN2CYP3A4CHRM1 | |
| SCHEMBL27937606 | 0.92 | ACHE (0.52) | ACHEHTTSMN1; SMN2CYP3A4CHRM1 | |
| Ethane SCHEMBL27836434 | 0.92 | ACHE (0.52) | ACHEHTTSMN1; SMN2CYP3A4CHRM1 | |
| Ammonia Solution, Strong SCHEMBL27518601 | 0.92 | ACHE (0.52) | ACHEHTTSMN1; SMN2CYP3A4CHRM1 | |
| SCHEMBL3806073 | 0.92 | ACHE (0.52) | ACHEHTTSMN1; SMN2CYP3A4CHRM1 | |
| Hydrochloric Acid SCHEMBL7074606 | 0.92 | ACHE (0.52) | ACHEHTTSMN1; SMN2CYP3A4CHRM1 | |
| SCHEMBL27319154 | 0.92 | ACHE (0.52) | ACHEHTTSMN1; SMN2CYP3A4CHRM1 | |
| SCHEMBL27871096 | 0.92 | ACHE (0.52) | ACHEHTTSMN1; SMN2CYP3A4CHRM1 |
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-4447658-A | COMPLEXING WITH A METAL HALIDE | KOPPERS COMPANY, INC. (US) | 1984-05-08 | — | — | US | claimed |