Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 14/20 | 0.88 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2415693 | 0.94 | S1PR1 (1.00) | S1PR1TP53POLBPIK3CAMTOR | |
| SCHEMBL2415287 | 0.90 | S1PR1 (0.70) | S1PR1TP53POLBS1PR3 | |
| SCHEMBL13345821 | 0.88 | S1PR1 (0.88) | S1PR1TP53POLBPIK3CAMTOR | |
| SCHEMBL13346042 | 0.79 | S1PR1 (0.73) | S1PR1TP53POLBS1PR3 | |
| SCHEMBL2410798 | 0.78 | S1PR1 (0.65) | S1PR1TP53POLB | |
| SCHEMBL2806750 | 0.78 | S1PR1 (0.71) | S1PR1TP53POLB | |
| SCHEMBL2414988 | 0.77 | S1PR1 (1.00) | S1PR1TP53POLB | |
| SCHEMBL2773184 | 0.76 | S1PR1 (0.69) | S1PR1TP53POLB | |
| SCHEMBL2772257 | 0.76 | S1PR1 (0.69) | S1PR1TP53POLB | |
| SCHEMBL2770910 | 0.76 | S1PR1 (0.68) | S1PR1TP53POLB |
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-2010069949-A1 | OXADIAZOLE FUSED HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF MULTIPLE SCLEROSIS | MERCK SERONO S.A. (CH) | 2010-06-24 | — | — | WO | disclosed |