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 | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1109607 | 0.97 | TP53 (0.48) | TP53ALDH1A1KDM4ETDP1CALM1 | |
| Fluoride Ion SCHEMBL10938266 | 0.94 | TP53 (0.46) | TP53ALDH1A1KDM4ETDP1CALM1 | |
| Hydrochloric Acid SCHEMBL968647 | 0.94 | ALDH1A1 (0.50) | TP53ALDH1A1KDM4ETDP1CALM1 | |
| Water SCHEMBL3190778 | 0.94 | TP53 (0.46) | TP53ALDH1A1KDM4ETDP1CALM1 | |
| Iodide SCHEMBL10884304 | 0.94 | TP53 (0.46) | TP53ALDH1A1KDM4ETDP1CALM1 | |
| SCHEMBL29441851 | 0.87 | TP53 (0.40) | TP53ALDH1A1KDM4ETDP1CALM1 | |
| SCHEMBL8757718 | 0.87 | TP53 (0.40) | TP53ALDH1A1KDM4ETDP1CALM1 | |
| SCHEMBL1135134 | 0.84 | TP53 (0.37) | TP53ALDH1A1KDM4ETDP1CALM1 | |
| Phosphoric Acid SCHEMBL11528106 | 0.84 | TSHR (0.38) | TP53ALDH1A1KDM4ETDP1TSHR | |
| Bromide SCHEMBL1046180 | 0.83 | TP53 (0.46) | TP53ALDH1A1KDM4ETDP1CALM1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0974595-B1 | PROCESS FOR PRODUCING BORON COMPOUNDS | SHOWA DENKO KK (JP) | 2003-10-01 | — | — | EP | disclosed |
| EP-0922708-B1 | Production method of borate compounds | SHOWA DENKO KK (JP) | 2003-05-14 | — | — | EP | disclosed |
| US-6140537-A | REACTING AN ORGANIC OXYBORON COMPOUND WITH LITHIUM, MAGNESIUM, OR COMPOUND THEREOF; FORMING BORON ANION COMPOUND; ION EXCHANGING | SHOWA DENKO K.K. (JP) | 2000-10-31 | — | — | US | disclosed |
| EP-0974595-A1 | PROCESS FOR PRODUCING BORON COMPOUNDS | Showa Denko Kabushiki Kaisha (JP) | 2000-01-26 | — | — | EP | disclosed |
| US-6002044-A | REACTING A LITHIUM OR MAGNEISIUM, A HALIDE AND A BORONATE PRECURSOR OBTAINED IN A FIRSST SIMILAR STEP USING A BORIDE; ADDING AN ONIIUM HALIDE TO THE METAL BORATE; PURITY | SHOWA DENKO K.K. (JP) | 1999-12-14 | — | — | US | disclosed |
| EP-0922708-A2 | Production method of borate compounds | SHOWA DENKO KABUSHIKI KAISHA (JP) | 1999-06-16 | — | — | EP | disclosed |