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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 known ✓ | P20309 | 16/20 | 0.47 |
| ▸ | CHRM2 known ✓ | P08172 | 9/20 | 0.39 |
| ▸ | CHRM1 known ✓ | P11229 | 9/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL7656451 | 0.92 | CHRM3 (0.43) | CHRM3CHRNA7CHRM2CHRM1HRH1 | |
| Bromide SCHEMBL7663198 | 0.81 | CCR5 (0.36) | CHRM3CHRNA7 | |
| Bromide SCHEMBL7655365 | 0.79 | ALOX15 (0.41) | CHRM3 | |
| Iodide SCHEMBL7653990 | 0.77 | CHRM3 (0.37) | CHRM3CHRM2CHRM1KCNH2APOBEC3A | |
| Bromide SCHEMBL7658481 | 0.76 | SMN1; SMN2 (0.40) | — | |
| Bromide SCHEMBL7650459 | 0.75 | ALOX15 (0.39) | CHRM3 | |
| Bromide SCHEMBL8399538 | 0.73 | PTGS1 (0.37) | — | |
| Bromide SCHEMBL7658326 | 0.72 | POLB (0.35) | — | |
| Iodide SCHEMBL7655990 | 0.72 | CHRM3 (0.32) | CHRM3 | |
| Bromide SCHEMBL7976104 | 0.72 | CHRNA7 (0.54) | CHRM3CHRNA7CHRM2CHRM1HRH1 |
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-6376510-B1 | ADMINISTERING A ALKOXY- AND ACYLOXY-SUBSTITUTED ARALKYL AND ARALKENYL BIS QUATERNARY AMMONIUM DERIVATIVES OF CYCLIC ALKANOL DIESTERS TO A HUMAN AS MUSCLE RELAXANTS | NEWLAXANT LLC | 2002-04-23 | — | — | US | disclosed |