Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 12/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1489133 | 0.93 | S1PR1 (0.47) | S1PR1ALDH1A1KDM4EHSD17B10TP53 | |
| SCHEMBL12830865 | 0.92 | S1PR1 (0.50) | S1PR1ALDH1A1KDM4EHSD17B10TP53 | |
| SCHEMBL1489469 | 0.91 | S1PR1 (0.50) | S1PR1ALDH1A1KDM4EHSD17B10TP53 | |
| SCHEMBL12830866 | 0.85 | S1PR1 (0.42) | S1PR1ALDH1A1KDM4EHSD17B10TP53 | |
| SCHEMBL1489066 | 0.85 | S1PR1 (0.49) | S1PR1ALDH1A1KDM4EHSD17B10TP53 | |
| SCHEMBL1488868 | 0.85 | S1PR1 (0.49) | S1PR1ALDH1A1S1PR3 | |
| SCHEMBL1489747 | 0.84 | S1PR1 (0.49) | S1PR1ALDH1A1KDM4EHSD17B10TP53 | |
| SCHEMBL1488687 | 0.83 | S1PR1 (0.46) | S1PR1ALDH1A1S1PR3 | |
| Hydrochloric Acid SCHEMBL1488822 | 0.82 | S1PR1 (0.46) | S1PR1ALDH1A1S1PR3 | |
| SCHEMBL1489001 | 0.79 | S1PR1 (0.51) | S1PR1ALDH1A1KDM4EHSD17B10TP53 |
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-2011035900-A1 | NEW THIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2011-03-31 | — | — | WO | disclosed |