Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 3/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | RIOK2 | Q9BVS4 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 SCHEMBL26600014 | 1.00 | PKM (0.43) | PKMHRH4HRH3CYP2D6TSHR | |
| SCHEMBL26669526 | 0.87 | HTR3E (0.45) | CYP2D6TSHRHTR6HTR3EHTR3B | |
| Trifluoroacetic Acid SCHEMBL30618993 | 0.81 | HTR1A (0.52) | PKMHRH4HRH3HTR6HTR3E | |
| Trifluoroacetic Acid SCHEMBL26600211 | 0.81 | PKM (0.48) | PKMHRH4HRH3CYP2D6TSHR | |
| Trifluoroacetic Acid SCHEMBL29701128 | 0.73 | HRH4 (0.45) | HRH4HRH3BACE1HTR6ADRB1 | |
| Trifluoroacetic Acid SCHEMBL2421451 | 0.73 | CYP2D6 (0.45) | HRH4HRH3CYP2D6TSHRCLK4 | |
| Trifluoroacetic Acid SCHEMBL26600238 | 0.72 | DRD2 (0.73) | PKMHTR6HTR3EHTR3BADRB1 | |
| Trifluoroacetic Acid SCHEMBL2119009 | 0.72 | CHRNB2 (0.68) | PKMHRH4HRH3HTR3EHTR3B | |
| Trifluoroacetic Acid SCHEMBL30618979 | 0.72 | CHRNB2 (0.68) | HTR3EHTR3BADRB1HTR3AHTR3D | |
| Trifluoroacetic Acid SCHEMBL26093287 | 0.72 | CHRNB2 (0.68) | PKMHRH4HRH3HTR3EHTR3B |
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 |