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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARD | Q03181 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NEK2 | P51955 | 1/20 | 0.32 |
| ▸ | ALPL | P05186 | 1/20 | 0.31 |
| ▸ | ALPI | P09923 | 1/20 | 0.31 |
| ▸ | ALPG | P10696 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10067621 | 0.84 | NEK2 (0.41) | PPARDLMNAALDH1A1RAB9AKDM4E | |
| SCHEMBL2955651 | 0.82 | PPARD (0.42) | PPARDLMNAALDH1A1PKMRAB9A | |
| SCHEMBL9602529 | 0.79 | HRH1 (0.41) | PPARDLMNAHTTSMN1; SMN2 | |
| SCHEMBL17817524 | 0.72 | GGPS1 (0.48) | LMNARAB9AKDM4EMAPTHTT | |
| SCHEMBL3658477 | 0.72 | NPY5R (0.42) | PPARDLMNAKDM4EMAPTNEK2 | |
| SCHEMBL2962216 | 0.70 | PPARD (0.40) | PPARD | |
| Bromide SCHEMBL31354627 | 0.70 | MEN1 (0.46) | PPARDLMNARAB9AKDM4EMAPT | |
| SCHEMBL13851329 | 0.69 | ALDH1A1 (0.50) | LMNAALDH1A1PKMRAB9AKDM4E | |
| SCHEMBL7425339 | 0.69 | SMN1; SMN2 (0.48) | ALDH1A1RAB9ANAMPTSMN1; SMN2 | |
| Bromide SCHEMBL2562587 | 0.69 | HTT (0.47) | PPARDMAPTHTTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2014659-A1 | New hybrid compounds of nucleobases and organic redox molecules and their use | Universität Osnabrück (DE) | 2009-01-14 | — | — | EP | disclosed |
| WO-2008148560-A1 | NEW HYBRID COMPOUNDS OF NUCLEOBASES AND ORGANIC REDOX MOLECULES AND THEIR USE | Universität Osnabrück (DE) | 2008-12-11 | — | — | WO | disclosed |