Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15833170 | 0.90 | CA12 (0.44) | CA12CA1CA2CA9 | |
| SCHEMBL17036885 | 0.87 | CA12 (0.44) | CA12CA1CA2CA9 | |
| SCHEMBL15833400 | 0.83 | CA12 (0.37) | CA12CA1CA2CA9CYP3A4 | |
| SCHEMBL17036888 | 0.81 | CA12 (0.37) | CA12CA1CA2CA9CYP3A4 | |
| SCHEMBL17036893 | 0.79 | CA12 (0.37) | CA12CA1CA2CA9CYP3A4 | |
| SCHEMBL20610940 | 0.77 | CA12 (0.36) | CA12CA1CA2CA9CYP3A4 | |
| SCHEMBL12360854 | 0.75 | ALDH1A1 (0.38) | CA12CA1CA2CA9 | |
| SCHEMBL17599666 | 0.74 | CA12 (0.33) | CA12CA1CA2CA9 | |
| SCHEMBL2171182 | 0.74 | TSHR (0.40) | CA12CA1CA2CA9TSHR | |
| SCHEMBL28587893 | 0.74 | CA12 (0.41) | CA12CA1CA2CA9 |
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-2014100505-A1 | SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF | ALIOS BIOPHARMA, INC. (US) | 2014-06-26 | — | — | WO | disclosed |