Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL404116 | 0.81 | AKR1B1 (0.40) | AKR1B1TDP1PAX8TSHR | |
| SCHEMBL13537813 | 0.78 | AKR1B1 (0.42) | AKR1B1TDP1PAX8TSHR | |
| SCHEMBL13384832 | 0.78 | AKR1B1 (0.42) | AKR1B1TDP1PAX8TSHR | |
| SCHEMBL13061771 | 0.76 | AKR1B1 (0.40) | AKR1B1TDP1PAX8TSHR | |
| SCHEMBL5617853 | 0.74 | — | — | |
| SCHEMBL14346962 | 0.73 | TDP1 (0.53) | TDP1TSHR | |
| SCHEMBL16074668 | 0.73 | TDP1 (0.53) | TDP1TSHR | |
| SCHEMBL13177064 | 0.72 | — | — | |
| SCHEMBL15889663 | 0.70 | TDP1 (0.50) | TDP1TSHR | |
| SCHEMBL18271003 | 0.70 | TDP1 (0.50) | TDP1TSHR |
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-2015022663-A1 | COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF MEK | NOVARTIS AG (CH) | 2015-02-19 | — | — | WO | claimed |