Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.38 |
| ▸ | CA2 | P00918 | 5/20 | 0.38 |
| ▸ | MMP1 | P03956 | 5/20 | 0.38 |
| ▸ | MMP2 | P08253 | 5/20 | 0.38 |
| ▸ | MMP9 | P14780 | 5/20 | 0.38 |
| ▸ | MMP8 | P22894 | 5/20 | 0.38 |
| ▸ | MMP13 | P45452 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8209700 | 0.99 | CA1 (0.38) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL1778770 | 0.89 | CA1 (0.51) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL3820635 | 0.87 | CA2 (0.50) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL7615808 | 0.87 | CA1 (0.46) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL9237821 | 0.84 | CA1 (0.35) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL10064117 | 0.83 | ALDH1A1 (0.36) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL3458873 | 0.82 | CA1 (0.38) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL4650786 | 0.81 | CA1 (0.37) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL998979 | 0.73 | CA1 (0.44) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL647332 | 0.72 | TSHR (0.37) | ALDH1A1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2167550-A1 | FLUORINATED COMPOSITIONS AND SURFACE TREATMENTS MADE THEREFROM | 3M Innovative Properties Company (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2008154279-A1 | FLUORINATED COMPOSITIONS AND SURFACE TREATMENTS MADE THEREFROM | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2008-12-18 | — | — | WO | disclosed |