Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.62 |
| ▸ | MEN1 | O00255 | 5/20 | 0.62 |
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL353230 | 0.89 | THRB (0.72) | THRBKMT2AMEN1NPC1GAA | |
| SCHEMBL31314589 | 0.89 | THRB (0.72) | THRBKMT2AMEN1NPC1GAA | |
| Fluoride SCHEMBL11495080 | 0.87 | THRB (0.70) | THRBKMT2AMEN1NPC1GAA | |
| SCHEMBL31175967 | 0.87 | THRB (0.70) | THRBKMT2AMEN1NPC1GAA | |
| SCHEMBL289795 | 0.86 | THRB (0.69) | THRBKMT2AMEN1NPC1GAA | |
| SCHEMBL17011343 | 0.85 | GAA (0.59) | THRBKMT2AMEN1NPC1GAA | |
| Acetic Acid SCHEMBL28287265 | 0.84 | THRB (0.66) | THRBKMT2AMEN1NPC1GAA | |
| SCHEMBL7408732 | 0.84 | THRB (0.71) | THRBKMT2AMEN1NPC1CYP1A2 | |
| SCHEMBL3864600 | 0.84 | THRB (0.75) | THRBKMT2AMEN1NPC1GAA | |
| SCHEMBL13545150 | 0.83 | THRB (0.69) | THRBKMT2AMEN1NPC1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1432700-B1 | SPIRO-HYDANTOIN COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS | BRISTOL MYERS SQUIBB CO (US) | 2009-11-04 | — | — | EP | disclosed |