Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 8/20 | 0.48 |
| ▸ | CES1 | P23141 | 10/20 | 0.48 |
| ▸ | CES2 | O00748 | 6/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13328445 | 0.91 | FAAH (0.59) | FAAHCES1CES2MEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL30656537 | 0.89 | FAAH (0.57) | FAAHCES1CES2MEN1CYP1A2 | |
| SCHEMBL12860094 | 0.84 | — | — | |
| SCHEMBL17378035 | 0.84 | FAAH (0.44) | FAAHCES1CES2MEN1CYP1A2 | |
| SCHEMBL11336120 | 0.82 | CES1 (0.50) | FAAHCES1CES2MEN1CYP1A2 | |
| SCHEMBL3803860 | 0.79 | FAAH (0.43) | FAAHCES1CES2MEN1CYP1A2 | |
| SCHEMBL269669 | 0.79 | CES1 (0.52) | FAAHCES1CES2MEN1CYP1A2 | |
| SCHEMBL23193786 | 0.78 | FAAH (0.32) | FAAHCES1CES2MEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL9458888 | 0.78 | FAAH (0.58) | FAAHCES1CES2MEN1CYP1A2 | |
| SCHEMBL31400165 | 0.78 | FAAH (0.52) | FAAHCES1CES2MEN1CYP1A2 |
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-1727799-B1 | NOVEL ALKYL-CONTAINING 5-ACYLINDOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL PRODUCTS | BOEHRINGER INGELHEIM INT (DE) | 2009-01-07 | — | — | EP | disclosed |