Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CTSA | P10619 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL2016331 | 0.91 | HTT (0.52) | HTTALDH1A1GLAGAAMAPT | |
| SCHEMBL2014823 | 0.91 | HTT (0.45) | HTTMEN1KMT2ACTSATP53 | |
| SCHEMBL2016153 | 0.90 | HTT (0.44) | HTTALDH1A1GLAGAAMAPT | |
| SCHEMBL2017836 | 0.89 | HTT (0.46) | HTTALDH1A1ACSS2MEN1KMT2A | |
| Iodide SCHEMBL2019625 | 0.89 | HTT (0.43) | HTTALDH1A1GLAGAAMAPT | |
| SCHEMBL2020338 | 0.89 | HTT (0.46) | HTTALDH1A1GLAGAAMAPT | |
| SCHEMBL2020396 | 0.89 | HTT (0.48) | HTTACSS2MEN1KMT2ATP53 | |
| SCHEMBL2018438 | 0.88 | SCNN1A (0.44) | HTTMAPTSMN1; SMN2ACSS2TP53 | |
| SCHEMBL12635756 | 0.88 | HTT (0.49) | HTTACSS2MEN1KMT2ATSHR | |
| SCHEMBL2015344 | 0.88 | HTT (0.47) | HTTMAPTSMN1; SMN2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011079087-A1 | ENAC BLOCKERS | GLAXO GROUP LIMITED (GB) | 2011-06-30 | — | — | WO | disclosed |
| WO-2011079087-A1 | ENAC BLOCKERS | GLAXO GROUP LIMITED (GB) | 2011-06-30 | — | — | WO | disclosed |