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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 4/20 | 0.36 |
| ▸ | CHRM1 known ✓ | P11229 | 3/20 | 0.36 |
| ▸ | CHRM3 known ✓ | P20309 | 7/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL4727245 | 0.99 | CHRM2 (0.37) | CHRM2CHRM1KCNH2SLC6A3LMNA | |
| SCHEMBL4779167 | 0.93 | CHRM3 (0.36) | CHRM2CHRM1KCNH2SLC6A3LMNA | |
| SCHEMBL4779696 | 0.91 | KCNH2 (0.36) | CHRM2CHRM1KCNH2SLC6A3LMNA | |
| SCHEMBL4779685 | 0.90 | CHRM2 (0.33) | CHRM2CHRM1KCNH2SLC6A3LMNA | |
| SCHEMBL4725504 | 0.84 | HRH1 (0.39) | CHRM2CHRM1KCNH2CYP2D6CHRM3 | |
| SCHEMBL4726237 | 0.83 | KCNH2 (0.38) | CHRM2CHRM1KCNH2SLC6A3LMNA | |
| Bromide SCHEMBL2877676 | 0.82 | CHRM2 (0.36) | CHRM2CHRM1KCNH2SLC6A3LMNA | |
| Bromide SCHEMBL2877682 | 0.82 | CHRM2 (0.36) | CHRM2CHRM1KCNH2SLC6A3LMNA | |
| Bromide SCHEMBL4728212 | 0.82 | CHRM2 (0.36) | CHRM2CHRM1KCNH2SLC6A3LMNA | |
| SCHEMBL4779865 | 0.81 | CHRM2 (0.36) | CHRM2CHRM1KCNH2SLC6A3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008023157-A1 | NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS USEFUL AS M3-RECEPTOR MODULATORS | ARGENTA DISCOVERY LIMITED (GB) | 2008-02-28 | — | — | WO | disclosed |