Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 9/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 5/20 | 0.48 |
| ▸ | CA2 | P00918 | 6/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6470795 | 0.81 | SLC1A3 (0.49) | CA2CA1 | |
| SCHEMBL8013573 | 0.79 | MMP2 (0.55) | CA2CA1 | |
| SCHEMBL22206134 | 0.77 | CA1 (0.54) | CA2CA1 | |
| SCHEMBL28230363 | 0.77 | CA1 (0.54) | CA2CA1 | |
| SCHEMBL125350 | 0.77 | GSR (0.59) | GSK3BPTPN1 | |
| SCHEMBL1200588 | 0.76 | CA1 (0.53) | CA2CA1 | |
| SCHEMBL23049688 | 0.76 | CA2 (0.48) | CA2CA1TAS2R14 | |
| SCHEMBL23049767 | 0.76 | CA2 (0.48) | CA2CA1TAS2R14 | |
| SCHEMBL27214045 | 0.75 | NPSR1 (0.54) | GSK3BPTPN1 | |
| SCHEMBL16232170 | 0.75 | MMP2 (0.50) | CA2CA1 |
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-2005110955-A1 | SUBSTITUTED ACETOPHENOME AS MS REAGENTS | GE HEALTHCARE BIO-SCIENCES AB (SE) | 2005-11-24 | — | — | WO | disclosed |