Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | GPR6 | P46095 | 15/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL26599430 | 1.00 | CYP2D6 (0.40) | CYP2D6TSHRCLK4GPR6MEN1 | |
| SCHEMBL26669581 | 0.88 | CYP1A2 (0.46) | CYP2D6TSHRCLK4MEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL26600211 | 0.85 | PKM (0.48) | CYP2D6TSHRCLK4MEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL26599587 | 0.82 | EPHX2 (0.50) | GPR6HRH4 | |
| Trifluoroacetic Acid SCHEMBL30619105 | 0.80 | CYP2D6 (0.42) | CYP2D6TSHRCLK4MEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL26600638 | 0.80 | CYP2D6 (0.42) | CYP2D6TSHRCLK4MEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL2421451 | 0.78 | CYP2D6 (0.45) | CYP2D6TSHRCLK4MEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL30619066 | 0.73 | KDM4E (0.39) | CLK4PKM | |
| SCHEMBL26669585 | 0.73 | GPR119 (0.48) | — | |
| SCHEMBL27665814 | 0.72 | CYP2D6 (0.49) | CYP2D6TSHRCLK4MEN1CYP1A2 |
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-2023205801-A2 | STEROIDAL COMPOSITIONS AND METHODS OF TREATING LIPOGENIC CANCERS | Asteroid Therapeutics (US) | 2023-10-26 | — | — | WO | disclosed |