Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 8/20 | 0.87 |
| ▸ | S1PR4 | O95977 | 7/20 | 0.87 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.87 |
| ▸ | TNNC1 | P63316 | 6/20 | 0.87 |
| ▸ | S1PR5 | Q9H228 | 5/20 | 0.87 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.87 |
| ▸ | GPR183 | P32249 | 1/20 | 0.87 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.87 |
| ▸ | SPHK2 | Q9NRA0 | 3/20 | 0.68 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.68 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.66 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.65 |
| ▸ | ESR1 | P03372 | 2/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.55 |
| ▸ | TACR2 | P21452 | 2/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8499430 | 1.00 | S1PR1 (0.87) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| SCHEMBL6262612 | 1.00 | S1PR1 (0.87) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| SCHEMBL8499516 | 1.00 | S1PR1 (0.87) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| Hydrochloric Acid SCHEMBL8499671 | 0.98 | S1PR1 (0.88) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| SCHEMBL8499443 | 0.97 | S1PR1 (0.81) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| SCHEMBL27358059 | 0.97 | S1PR1 (0.87) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| SCHEMBL8497561 | 0.97 | S1PR1 (0.87) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| SCHEMBL6499253 | 0.95 | S1PR1 (0.79) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| SCHEMBL6507074 | 0.95 | S1PR1 (0.79) | S1PR1S1PR4S1PR3TNNC1S1PR5 | |
| SCHEMBL8500209 | 0.95 | S1PR1 (0.78) | S1PR1S1PR4S1PR3TNNC1S1PR5 |
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 |