Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 6/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | LGALS3 | P17931 | 2/20 | 0.40 |
| ▸ | TLR4 | O00206 | 3/20 | 0.39 |
| ▸ | LY96 | Q9Y6Y9 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9514279 | 0.93 | SMPD1 (0.42) | SMPD1CA1CA2CA9LGALS3 | |
| SCHEMBL9513498 | 0.92 | SMPD1 (0.42) | SMPD1CA1CA2CA9CNR2 | |
| SCHEMBL10417944 | 0.92 | TLR4 (0.48) | SMPD1CA1CA2CA9LGALS3 | |
| SCHEMBL9511533 | 0.92 | TLR4 (0.48) | SMPD1CA1CA2CA9LGALS3 | |
| SCHEMBL8431503 | 0.90 | LGALS3 (0.42) | SMPD1CA1CA2CA9LGALS3 | |
| SCHEMBL8431497 | 0.90 | LGALS3 (0.42) | SMPD1CA1CA2CA9LGALS3 | |
| SCHEMBL10419023 | 0.88 | CA1 (0.47) | SMPD1CA1CA2CA9LGALS3 | |
| SCHEMBL10419025 | 0.88 | CA1 (0.47) | SMPD1CA1CA2CA9LGALS3 | |
| SCHEMBL6807592 | 0.85 | SMPD1 (0.41) | SMPD1TLR4LY96CNR2S1PR3 | |
| SCHEMBL9514287 | 0.83 | TLR4 (0.41) | SMPD1LGALS3TLR4LY96CNR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0288888-B1 | Novel glucopyranose derivatives | ONO PHARMACEUTICAL CO (JP) | 1993-12-08 | — | — | EP | claimed |
| EP-0288888-A2 | Novel glucopyranose derivatives | ONO PHARMACEUTICAL CO., LTD. (JP) | 1988-11-02 | — | — | EP | claimed |
| US-4925929-A | ANTITUMOR AGENTS | ONO PHARMACEUTICAL CO. LTD. (JP) | 1990-05-15 | — | — | US | disclosed |