Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
| ▸ | PPARA | Q07869 | 4/20 | 0.53 |
| ▸ | PPARG | P37231 | 3/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.53 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.47 |
| ▸ | SMPD1 | P17405 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8496223 | 1.00 | CNR1 (0.53) | CNR1CNR2PPARAPPARGCYP2D6 | |
| SCHEMBL6262237 | 0.88 | CNR1 (0.50) | CNR1CNR2PPARAPPARGCYP2D6 | |
| SCHEMBL8500379 | 0.86 | S1PR1 (0.52) | — | |
| SCHEMBL8496083 | 0.82 | TP53 (0.51) | PLA2G4B | |
| SCHEMBL8535556 | 0.82 | ATM (0.58) | CNR1CNR2PPARAPPARGCYP2D6 | |
| SCHEMBL6262473 | 0.82 | GGPS1 (0.54) | CNR1CNR2PPARAPPARGCYP2D6 | |
| SCHEMBL7712079 | 0.81 | CYP2D6 (0.49) | CNR1CNR2PPARAPPARGCYP2D6 | |
| Hydrochloric Acid SCHEMBL8500465 | 0.81 | S1PR1 (0.54) | CNR1CNR2PPARAPPARGCYP2D6 | |
| SCHEMBL8496714 | 0.81 | S1PR1 (0.56) | PLA2G4B | |
| SCHEMBL8495872 | 0.79 | L3MBTL1 (0.52) | PPARA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5952316-A | FOR TREATING AUTOIMMUNE DISEASES, E.G., RHEUMATIOD ARTHRITIS | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1999-09-14 | — | — | US | disclosed |
| EP-0627406-B1 | 2-AMINO-1,3-PROPANEDIOL COMPOUND AND IMMUNOSUPPRESSANT | YOSHITOMI PHARMACEUTICAL (JP) | 1998-10-28 | — | — | EP | disclosed |
| US-5719176-A | 2-amino-1,3-propanediol compound and immunosuppressant | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1998-02-17 | — | — | US | disclosed |
| US-5604229-A | 2-amino-1,3-propanediol compound and immunosuppressant | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1997-02-18 | — | — | US | disclosed |
| EP-0627406-A1 | 2-AMINO-1,3-PROPANEDIOL COMPOUND AND IMMUNOSUPPRESSANT | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1994-12-07 | — | — | EP | disclosed |