Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 19/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 11/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 3/20 | 0.34 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6825017 | 1.00 | S1PR3 (0.37) | S1PR3S1PR1S1PR2S1PR4 | |
| SCHEMBL6791191 | 0.76 | MMP2 (0.35) | — | |
| SCHEMBL6798968 | 0.76 | HSD17B2 (0.40) | — | |
| SCHEMBL6800602 | 0.74 | TDP1 (0.45) | — | |
| SCHEMBL2873657 | 0.73 | GAA (0.41) | S1PR3 | |
| SCHEMBL6824813 | 0.72 | S1PR3 (0.34) | S1PR3S1PR1S1PR2S1PR4 | |
| SCHEMBL6919077 | 0.72 | S1PR3 (0.34) | S1PR3S1PR1S1PR2S1PR4 | |
| SCHEMBL6703699 | 0.70 | BACE1 (0.32) | — | |
| SCHEMBL10620249 | 0.69 | ALDH1A1 (0.41) | — | |
| SCHEMBL13001686 | 0.68 | TSHR (0.52) | S1PR1 |
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-2004024060-A2 | METALLOPROTEINASE INHIBITORS AND INTERMEDIATES FOR PREPARATION THEREOF | ASTRAZENECA AB (SE) | 2004-03-25 | — | — | WO | disclosed |