Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 5/20 | 0.48 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.47 |
| ▸ | NAAA | Q02083 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | RARB | P10826 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5478921 | 0.98 | ALDH1A1 (0.54) | ALDH1A1ATMMEN1THRBHTT | |
| SCHEMBL12544794 | 0.96 | ALDH1A1 (0.52) | ALDH1A1ATMMEN1THRBHTT | |
| SCHEMBL1032757 | 0.93 | TSHR (0.50) | ALDH1A1ATMMEN1THRBHTT | |
| SCHEMBL11145409 | 0.93 | TSHR (0.50) | ALDH1A1ATMMEN1THRBHTT | |
| SCHEMBL5483768 | 0.93 | TSHR (0.50) | ALDH1A1ATMMEN1THRBHTT | |
| SCHEMBL5487135 | 0.93 | TSHR (0.50) | ALDH1A1ATMMEN1THRBHTT | |
| SCHEMBL15135540 | 0.93 | ALDH1A1 (0.54) | ALDH1A1ATMMEN1THRBHTT | |
| SCHEMBL5932404 | 0.91 | NAAA (0.57) | ALDH1A1MEN1THRBHTTKMT2A | |
| SCHEMBL27994211 | 0.91 | TSHR (0.48) | ALDH1A1ATMMEN1THRBHTT | |
| SCHEMBL5933104 | 0.91 | MEN1 (0.54) | ALDH1A1MEN1THRBHTTKMT2A |
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-1744394-A1 | NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2007-01-17 | — | — | EP | disclosed |