Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10235257 | 0.83 | S1PR1 (0.32) | S1PR1S1PR3MAPK1 | |
| Hydrochloric Acid SCHEMBL9953137 | 0.82 | S1PR1 (0.31) | S1PR1S1PR3MAPK1 | |
| SCHEMBL18263309 | 0.79 | LMNA (0.38) | MAPK1 | |
| SCHEMBL25023639 | 0.78 | S1PR1 (0.34) | S1PR1S1PR3MAPK1 | |
| SCHEMBL9952921 | 0.78 | PLAU (0.36) | S1PR1S1PR3MAPK1 | |
| SCHEMBL10272604 | 0.78 | CRHR1 (0.38) | S1PR1S1PR3MAPK1 | |
| SCHEMBL6866870 | 0.78 | PRMT5 (0.36) | S1PR1S1PR3MAPK1 | |
| Hydrochloric Acid SCHEMBL17824239 | 0.76 | PRMT5 (0.36) | S1PR1S1PR3MAPK1 | |
| SCHEMBL22719098 | 0.74 | HTT (0.35) | S1PR1S1PR3 | |
| SCHEMBL30854360 | 0.74 | LTA4H (0.32) | S1PR1S1PR3MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2991994-A1 | THIAZOLOPYRROLIDINE INHIBITORS OF ROR-GAMMA | Vitae Pharmaceuticals, Inc. (US) | 2016-03-09 | — | — | EP | disclosed |
| WO-2014179564-A1 | THIAZALOPYRROLIDINE INHIBITORS OF ROR-GAMMA | VITAE PHARMACEUTICALS, INC. (US) | 2014-11-06 | — | — | WO | disclosed |