Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 11/20 | 0.38 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.35 |
| ▸ | ESR1 | P03372 | 5/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709407 | 0.90 | TP53 (0.39) | MITF | |
| SCHEMBL1709409 | 0.89 | POLB (0.38) | DGAT1 | |
| SCHEMBL1709480 | 0.89 | NPC1 (0.38) | DGAT1 | |
| SCHEMBL10033121 | 0.87 | USP30 (0.38) | — | |
| SCHEMBL1709359 | 0.86 | USP30 (0.38) | DGAT1CYP3A4 | |
| SCHEMBL1709405 | 0.86 | TACR1 (0.38) | DGAT1 | |
| SCHEMBL1709497 | 0.86 | EPHX2 (0.43) | DGAT1 | |
| SCHEMBL10032832 | 0.85 | TACR1 (0.36) | DGAT1 | |
| SCHEMBL10032831 | 0.85 | TACR1 (0.36) | DGAT1 | |
| SCHEMBL1709459 | 0.84 | CXCR3 (0.34) | — |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |