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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13819918 | 0.98 | — | — | |
| Iodide SCHEMBL8679188 | 0.95 | TP53 (0.39) | TP53NPC1POLBRAB9ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5316437 | 0.95 | TP53 (0.39) | TP53NPC1POLBRAB9ASMN1; SMN2 | |
| Bromide SCHEMBL19063544 | 0.74 | HDAC8 (0.44) | TP53NPC1POLBRAB9ASMN1; SMN2 | |
| SCHEMBL8305261 | 0.74 | — | — | |
| SCHEMBL18685357 | 0.74 | ESR1 (0.34) | NPC1POLBRAB9ASMN1; SMN2 | |
| Bromide SCHEMBL15941654 | 0.73 | NPC1 (0.41) | TP53NPC1POLBRAB9ASMN1; SMN2 | |
| Bromide SCHEMBL10904035 | 0.73 | TP53 (0.39) | TP53NPC1POLBRAB9ASMN1; SMN2 | |
| SCHEMBL29729219 | 0.71 | — | — | |
| SCHEMBL329433 | 0.71 | — | — |
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-6680286-B1 | CONTAINING AN ORGANIC POLYELECTROLYTE BUILDER, QUATERNARY AMMONIUM ACRYLIC POLYMERS, WHICH ARE ESPECIALLY USEFUL FOR WASHING CLOTHES | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 2004-01-20 | — | — | US | disclosed |