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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 12/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4602343 | 0.98 | TSHR (0.44) | DNM1TSHRHTT | |
| Hydrochloric Acid SCHEMBL28899726 | 0.96 | TSHR (0.47) | DNM1TSHRHSP90AA1RAD52HTT | |
| Hydrochloric Acid SCHEMBL29163705 | 0.96 | TSHR (0.47) | DNM1TSHRHSP90AA1RAD52HTT | |
| Hydrochloric Acid SCHEMBL28899614 | 0.96 | TSHR (0.47) | DNM1TSHRHSP90AA1RAD52HTT | |
| Hydrochloric Acid SCHEMBL28899670 | 0.96 | TSHR (0.47) | DNM1TSHRHSP90AA1RAD52HTT | |
| Hydrochloric Acid SCHEMBL28899621 | 0.96 | TSHR (0.47) | DNM1TSHRHSP90AA1RAD52HTT | |
| Propylamine SCHEMBL2760772 | 0.90 | TSHR (0.42) | DNM1TSHRHSP90AA1RAD52HTT | |
| SCHEMBL17036766 | 0.81 | BBOX1 (0.34) | TSHR | |
| Bromide SCHEMBL11038659 | 0.79 | DNM1 (0.52) | DNM1TSHRALDH1A1TP53CYP3A4 | |
| Hydrochloric Acid SCHEMBL2760773 | 0.79 | PAOX (0.41) | TSHRALDH1A1ALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100535037-C | Surface treatment method by photopolymerization to obtain biocidal properties | DESARROLLO DEL GRAFTING S L (ES) | 2009-09-02 | — | — | CN | disclosed |
| CN-1711309-A | Surface treatment method for obtaining biocidal properties by photopolymerization | DESARROLLO DEL GRAFTING S L (ES) | 2005-12-21 | — | — | CN | disclosed |