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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 7/20 | 0.58 |
| ▸ | CASP1 | P29466 | 5/20 | 0.58 |
| ▸ | CASP7 | P55210 | 5/20 | 0.58 |
| ▸ | BRCA1 | P38398 | 2/20 | 0.58 |
| ▸ | HBB | P68871 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 8/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.55 |
| ▸ | LMNA | P02545 | 6/20 | 0.55 |
| ▸ | GAA | P10253 | 5/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | RECQL | P46063 | 3/20 | 0.55 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4304332 | 0.99 | SLC16A3 (0.57) | USP2CASP1CASP7BRCA1HBB | |
| Sulfuric Acid SCHEMBL4451220 | 0.92 | SLC16A3 (0.53) | USP2CASP1CASP7BRCA1HBB | |
| SCHEMBL4304973 | 0.88 | USP2 (0.47) | USP2CASP1CASP7BRCA1HBB | |
| Bromide SCHEMBL4303545 | 0.87 | SLC16A3 (0.56) | USP2CASP1CASP7BRCA1HBB | |
| SCHEMBL15398194 | 0.85 | USP2 (0.66) | USP2CASP1CASP7BRCA1HBB | |
| SCHEMBL4303802 | 0.85 | SLC16A3 (0.57) | USP2CASP1CASP7BRCA1HBB | |
| Bromide SCHEMBL4298654 | 0.84 | USP2 (0.53) | USP2CASP1CASP7BRCA1HBB | |
| SCHEMBL4309506 | 0.84 | USP2 (0.61) | USP2CASP1CASP7BRCA1HBB | |
| SCHEMBL15398217 | 0.84 | USP2 (0.64) | USP2CASP1CASP7BRCA1HBB | |
| Bromide SCHEMBL4448236 | 0.83 | USP2 (0.57) | USP2CASP1CASP7BRCA1HBB |
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-2009124800-A1 | CATIONIC DIRECT DYES AND AGENTS FOR DYEING FIBERS CONTAINING KERATIN | HENKEL AG & CO. KGAA (DE) | 2009-10-15 | — | — | WO | disclosed |