Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NAMPT | P43490 | 5/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10259357 | 0.89 | ROCK2 (0.62) | HTTALDH1A1CYP3A4LMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4518678 | 0.88 | ROCK2 (0.61) | HTTALDH1A1CYP3A4LMNASMN1; SMN2 | |
| SCHEMBL28106835 | 0.80 | ALDH1A1 (0.51) | HTTALDH1A1CYP3A4LMNAGAA | |
| SCHEMBL14843314 | 0.80 | ALDH1A1 (0.51) | HTTALDH1A1CYP3A4LMNAGAA | |
| Hydrochloric Acid SCHEMBL16209092 | 0.79 | ALDH1A1 (0.50) | HTTALDH1A1CYP3A4LMNAGAA | |
| Bromide SCHEMBL16208931 | 0.79 | ALDH1A1 (0.50) | HTTALDH1A1CYP3A4LMNAGAA | |
| SCHEMBL28216290 | 0.78 | LMNA (0.50) | HTTALDH1A1CYP3A4CA9LMNA | |
| SCHEMBL8806977 | 0.75 | LMNA (0.49) | ALDH1A1CYP3A4LMNA | |
| SCHEMBL4535633 | 0.74 | AAK1 (0.56) | HTTALDH1A1CYP3A4LMNASMN1; SMN2 | |
| SCHEMBL10259810 | 0.74 | AAK1 (0.56) | HTTALDH1A1CYP3A4LMNASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102482234-A | Nitrogen-containing compounds and pharmaceutical compositions | OTSUKA PHARMA CO LTD | 2012-05-30 | — | — | CN | disclosed |