Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.31 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27686509 | 0.77 | CES1 (0.43) | CES1TSHRCES2ALDH1A1TP53 | |
| SCHEMBL22764842 | 0.76 | — | — | |
| SCHEMBL13359172 | 0.74 | CES1 (0.42) | CES1HPGDTSHRCES2ZDHHC20 | |
| SCHEMBL184574 | 0.73 | — | — | |
| SCHEMBL184575 | 0.73 | — | — | |
| SCHEMBL8583365 | 0.73 | — | — | |
| SCHEMBL788274 | 0.73 | — | — | |
| SCHEMBL788273 | 0.73 | — | — | |
| SCHEMBL20837673 | 0.73 | CES1 (0.31) | CES1HPGDTSHRCES2ALDH1A1 | |
| SCHEMBL21882660 | 0.73 | ALDH1A1 (0.37) | CES1HPGDTSHRCES2ALDH1A1 |
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-2014285-B1 | NPYY5 antagonists | SHIONOGI & CO (JP) | 2010-05-05 | — | — | EP | disclosed |