Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 6/20 | 0.45 |
| ▸ | CA1 | P00915 | 5/20 | 0.45 |
| ▸ | MMP2 | P08253 | 2/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 5/20 | 0.45 |
| ▸ | CA12 | O43570 | 4/20 | 0.45 |
| ▸ | CA7 | P43166 | 2/20 | 0.45 |
| ▸ | CA3 | P07451 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.45 |
| ▸ | GBA1 | P04062 | 1/20 | 0.44 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL680246 | 0.85 | GAA (0.50) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL3442044 | 0.79 | TLR9 (0.44) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL1149214 | 0.78 | GAA (0.56) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL178444 | 0.78 | GAA (0.56) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL30896660 | 0.78 | GAA (0.56) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL9385444 | 0.76 | GAA (0.54) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL26343853 | 0.75 | GAA (0.59) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL15478776 | 0.74 | GAA (0.52) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL7092154 | 0.74 | GAA (0.52) | GAASMN1; SMN2CA2CA1MMP2 | |
| SCHEMBL13367643 | 0.74 | GAA (0.52) | GAASMN1; SMN2CA2CA1MMP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012085857-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-3-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |
| WO-2012085852-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-8-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |