Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.50 |
| ▸ | CA1 | P00915 | 4/20 | 0.50 |
| ▸ | CA9 | Q16790 | 4/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.37 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9482613 | 0.90 | ALDH1A1 (0.52) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL17471893 | 0.85 | ALDH1A1 (0.48) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL31286636 | 0.80 | CA12 (0.58) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL23458079 | 0.80 | CA12 (0.50) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL23458132 | 0.80 | CA12 (0.50) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL12132052 | 0.79 | ALDH1A1 (0.43) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL11802604 | 0.79 | CA12 (0.54) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL15739776 | 0.78 | GRIN2D (0.51) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL7695080 | 0.78 | — | — | |
| SCHEMBL8277481 | 0.77 | CA12 (0.36) | CA12CA1CA9CA2ALDH1A1 |
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-2013090276-A1 | SALEN COMPLEXES WITH DIANIONIC COUNTERIONS | NOVOMER, INC. (US) | 2013-06-20 | — | — | WO | disclosed |