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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.73 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.47 |
| ▸ | RAD52 | P43351 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28582384 | 0.92 | TSHR (0.65) | TSHRDNM1THRBALDH1A1TP53 | |
| SCHEMBL2744210 | 0.92 | TSHR (0.65) | TSHRDNM1THRBALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL28573850 | 0.92 | TSHR (0.65) | TSHRDNM1THRBALDH1A1TP53 | |
| SCHEMBL11097565 | 0.92 | TSHR (0.65) | TSHRDNM1THRBALDH1A1TP53 | |
| Bromide SCHEMBL4592298 | 0.92 | TSHR (0.64) | TSHRDNM1RAD52NPSR1THRB | |
| SCHEMBL6863232 | 0.91 | TSHR (0.66) | TSHRDNM1RAD52NPSR1THRB | |
| Hydrochloric Acid SCHEMBL27656623 | 0.91 | TSHR (0.66) | TSHRDNM1RAD52NPSR1THRB | |
| Hydrochloric Acid SCHEMBL27656702 | 0.91 | TSHR (0.66) | TSHRDNM1RAD52NPSR1THRB | |
| SCHEMBL13655572 | 0.91 | TSHR (0.77) | TSHRDNM1RAD52NPSR1THRB | |
| Hydrochloric Acid SCHEMBL2798756 | 0.89 | TSHR (0.62) | TSHRDNM1RAD52NPSR1THRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0531005-A2 | Micro-emulsions | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-03-10 | — | — | EP | disclosed |