Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.31 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.31 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10337981 | 0.86 | GAA (0.33) | SMN1; SMN2KDM4EKMT2AMEN1 | |
| SCHEMBL4234398 | 0.86 | SLC6A2 (0.33) | SLC6A2SLC6A4SLC6A3NPC1CYP1A2 | |
| SCHEMBL5984481 | 0.81 | MEN1 (0.37) | SLC6A2SLC6A4SLC6A3NPC1CYP1A2 | |
| SCHEMBL29039536 | 0.80 | THRB (0.32) | — | |
| SCHEMBL6903846 | 0.79 | SMN1; SMN2 (0.32) | NPC1CYP1A2CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL29154634 | 0.78 | GAA (0.33) | SMN1; SMN2 | |
| SCHEMBL27681208 | 0.77 | FAAH (0.37) | SLC6A2SLC6A4CYP2C19RAB9AKMT2A | |
| SCHEMBL8380025 | 0.77 | SOAT1 (0.37) | KDM4EKMT2AMEN1 | |
| SCHEMBL9331797 | 0.77 | SOAT1 (0.37) | KDM4EKMT2AMEN1 | |
| SCHEMBL28365819 | 0.77 | NPC1 (0.32) | NPC1CYP1A2CYP2C19RAB9ASMN1; SMN2 |
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-1993025631-A1 | LIQUID CRYSTAL COMPOUNDS, MIXTURES AND DEVICES | THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) | 1993-12-23 | — | — | WO | disclosed |