Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL7009728 | 0.76 | — | — | |
| SCHEMBL2810235 | 0.69 | CYP3A4 (0.44) | THRBCYP3A4 | |
| SCHEMBL7953582 | 0.65 | CYP3A4 (0.44) | THRBCYP3A4 | |
| SCHEMBL7084327 | 0.65 | TDP2 (0.35) | — | |
| SCHEMBL13668279 | 0.63 | CYP26A1 (0.32) | — | |
| SCHEMBL2381170 | 0.61 | SMN1; SMN2 (0.42) | THRBCYP3A4 | |
| SCHEMBL18493977 | 0.61 | HPGD (0.39) | CYP3A4 | |
| SCHEMBL15448023 | 0.61 | ALDH1A1 (0.39) | THRBCYP3A4 | |
| SCHEMBL19570319 | 0.61 | THRB (0.40) | THRBCYP3A4 | |
| SCHEMBL19334322 | 0.60 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1390337-A1 | PRECURSORS FOR KETONES AND ALDEHYDES | Givaudan SA (CH) | 2004-02-25 | — | — | EP | disclosed |
| WO-2002096850-A1 | PRECURSORS FOR KETONES AND ALDEHYDES | GIVAUDAN SA (CH) | 2002-12-05 | — | — | WO | disclosed |