Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 6/20 | 0.46 |
| ▸ | SYK | P43405 | 9/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 6/20 | 0.41 |
| ▸ | INCENP | Q9NQS7 | 6/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.39 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2117215 | 0.88 | S1PR1 (0.60) | S1PR1CYP2C9CYP2C19 | |
| SCHEMBL2115112 | 0.88 | S1PR1 (0.60) | S1PR1CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL2115827 | 0.87 | S1PR1 (0.59) | S1PR1CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL2115922 | 0.87 | S1PR1 (0.59) | S1PR1CYP2C9CYP2C19 | |
| SCHEMBL2117073 | 0.74 | S1PR1 (0.65) | S1PR1 | |
| Hydrochloric Acid SCHEMBL2115288 | 0.73 | S1PR1 (0.64) | S1PR1 | |
| SCHEMBL2117587 | 0.70 | S1PR1 (0.51) | S1PR1 | |
| SCHEMBL2117198 | 0.70 | S1PR1 (0.51) | S1PR1 | |
| SCHEMBL2117645 | 0.69 | S1PR1 (0.61) | S1PR1CYP2C9 | |
| SCHEMBL2115571 | 0.69 | S1PR1 (0.61) | S1PR1CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010145202-A1 | THIAZOLE OR THIADIZALOE DERIVATIVES FOR USE AS SPHINGOSINE 1-PHOSPHATE 1 (S1P1) RECEPTOR AGONISTS | GLAXO GROUP LIMITED (GB) | 2010-12-23 | — | — | WO | disclosed |