Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SCN1A | P35498 | 2/20 | 0.32 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | PTPRF | P10586 | 1/20 | 0.32 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9465854 | 0.85 | MAPT (0.40) | ALDH1A1CYP2C9MAPTLMNANPC1 | |
| SCHEMBL9166043 | 0.84 | RARB (0.36) | ALDH1A1MAPTOPRD1TSHR | |
| SCHEMBL9465980 | 0.84 | CYP2C9 (0.37) | ALDH1A1CYP2C9MAPTLMNANPC1 | |
| SCHEMBL9465609 | 0.82 | CTSK (0.37) | ALDH1A1CYP2C9MAPTLMNANPC1 | |
| SCHEMBL9466635 | 0.82 | LSS (0.38) | ALDH1A1CYP2C9MAPTLMNANPC1 | |
| SCHEMBL9465164 | 0.82 | HPGD (0.34) | ALDH1A1CYP2C19CYP1A2CYP3A4TSHR | |
| SCHEMBL9465266 | 0.81 | THRB (0.41) | CYP2C9MAPTLMNANPC1SMN1; SMN2 | |
| SCHEMBL9465202 | 0.81 | HDAC3 (0.38) | ALDH1A1CYP2C9LMNANPC1SMN1; SMN2 | |
| SCHEMBL9466115 | 0.81 | THRB (0.46) | CYP2C9MAPTLMNANPC1SMN1; SMN2 | |
| SCHEMBL9159054 | 0.81 | GAA (0.31) | MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5204018-A | LIQUID CRYSTALS | HOFFMANN-LA ROCHE INC. (US) | 1993-04-20 | — | — | US | disclosed |