Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 15/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16398065 | 0.84 | MEN1 (0.40) | ESR1 | |
| SCHEMBL16398232 | 0.82 | NPC1 (0.33) | ESR1 | |
| SCHEMBL16398007 | 0.81 | IL1B (0.38) | ESR1 | |
| SCHEMBL16398422 | 0.81 | CYP1A2 (0.37) | ESR1TLR7HRH4 | |
| SCHEMBL16398055 | 0.79 | IDH1 (0.42) | PTGS2TLR7 | |
| SCHEMBL16398255 | 0.78 | THRB (0.33) | ESR1 | |
| SCHEMBL16397929 | 0.75 | MALT1 (0.37) | PTGS2 | |
| SCHEMBL16397831 | 0.74 | TACR1 (0.36) | — | |
| SCHEMBL17728110 | 0.73 | CYP17A1 (0.39) | — | |
| SCHEMBL16398504 | 0.73 | TACR1 (0.30) | — |
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-3004079-A1 | PYRIMIDINE COMPOUNDS AND THEIR USE AS GAMMA SECRETASE MODULATORS | Acturum Life Science AB (SE) | 2016-04-13 | — | — | EP | disclosed |
| WO-2014195323-A1 | PYRIMIDINE COMPOUNDS AND THEIR USE AS GAMMA SECRETASE MODULATORS | Acturum Life Science AB (SE) | 2014-12-11 | — | — | WO | disclosed |