Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 10/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL27819947 | 0.88 | GAA (0.50) | CES2CES1ALDH1A1ALOX15GAA | |
| SCHEMBL29362410 | 0.81 | CES2 (0.61) | CES2CES1ALDH1A1ALOX15GAA | |
| SCHEMBL1885454 | 0.81 | CES2 (0.47) | CES2CES1ALDH1A1ALOX15GAA | |
| SCHEMBL11000200 | 0.80 | CES2 (0.50) | CES2CES1ALDH1A1ALOX15GAA | |
| SCHEMBL2662687 | 0.79 | CES2 (0.46) | CES2CES1ALDH1A1ALOX15GAA | |
| SCHEMBL31414991 | 0.79 | HIF1A (0.47) | CES2CES1ALDH1A1ALOX15GAA | |
| SCHEMBL2527057 | 0.79 | HIF1A (0.47) | CES2CES1ALDH1A1ALOX15GAA | |
| SCHEMBL22917054 | 0.78 | CES2 (0.48) | CES2CES1ALDH1A1GAAHDAC4 | |
| SCHEMBL11043071 | 0.76 | ACP3 (0.44) | CES2CES1ALDH1A1HIF1A | |
| SCHEMBL23032493 | 0.75 | CES2 (0.46) | CES2CES1GAAHDAC4CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6468998-B1 | ANTAGONIZE SEROTONIN 2 RECEPTORS, SUPPRESS PLATELET AGGREGATION, IMPROVE PERIPHERAL CIRCULATION AND PROMOTE LACHRYMATION | MITSUBISHI PHARMA CORPORATION (JP) | 2002-10-22 | — | — | US | disclosed |
| EP-1125922-A1 | PYRROLIDINE COMPOUNDS AND MEDICINAL UTILIZATION THEREOF | Welfide Corporation (JP) | 2001-08-22 | — | — | EP | disclosed |