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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 4/20 | 0.52 |
| ▸ | CHKA known ✓ | P35790 | 7/20 | 0.43 |
| ▸ | BCHE | P06276 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6554627 | 0.98 | ACHE (0.48) | ACHEBCHECHKAALDH1A1CYP2A6 | |
| Bromide SCHEMBL2831425 | 0.83 | ACHE (0.68) | ACHEBCHECHKAALDH1A1SMN1; SMN2 | |
| SCHEMBL1426439 | 0.82 | ALDH1A1 (0.52) | ACHECHKAALDH1A1CYP2A6SMN1; SMN2 | |
| SCHEMBL10325407 | 0.81 | ACHE (0.64) | ACHEBCHECHKAALDH1A1SMN1; SMN2 | |
| Bromide SCHEMBL30071025 | 0.81 | ACHE (0.52) | ACHEBCHECHKAALDH1A1SMN1; SMN2 | |
| SCHEMBL4625276 | 0.80 | KDM4A (0.47) | CHKAALDH1A1CYP2A6SMN1; SMN2LMNA | |
| SCHEMBL1899609 | 0.80 | KDM4A (0.47) | CHKAALDH1A1CYP2A6SMN1; SMN2LMNA | |
| Bromide SCHEMBL9397400 | 0.80 | CHKA (0.43) | ACHEBCHECHKAALDH1A1 | |
| Hydrochloric Acid SCHEMBL11637202 | 0.79 | ACHE (0.61) | ACHEBCHECHKAALDH1A1SMN1; SMN2 | |
| SCHEMBL17686001 | 0.78 | BCHE (0.48) | ACHEBCHECHKAALDH1A1SMN1; SMN2 |
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-5334485-A | Containing n-heterocyclic ring | THE CHROMALINE CORPORATION (US) | 1994-08-02 | — | — | US | disclosed |