Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 11/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 5/20 | 0.44 |
| ▸ | PPARA | Q07869 | 3/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13433626 | 1.00 | S1PR1 (0.53) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3415203 | 1.00 | S1PR1 (0.53) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3418743 | 0.91 | S1PR1 (0.62) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3418738 | 0.91 | S1PR1 (0.62) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3418693 | 0.86 | NPC1 (0.61) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3418694 | 0.86 | NPC1 (0.61) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3414348 | 0.85 | S1PR1 (0.53) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3414346 | 0.85 | S1PR1 (0.53) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3410496 | 0.85 | NPC1 (0.55) | S1PR1NPC1RAB9APPARGPPARA | |
| SCHEMBL3410501 | 0.85 | NPC1 (0.55) | S1PR1NPC1RAB9APPARGPPARA |
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-7687664-B2 | Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-03-30 | — | — | US | disclosed |
| EP-1394147-A1 | CARBOXYLIC ACID DERIVATIVE AND MEDICINE COMPRISING SALT OR ESTER OF THE SAME | Eisai Co., Ltd. (JP) | 2004-03-03 | — | — | EP | disclosed |