Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5211417 | 0.85 | TSHR (0.36) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| SCHEMBL5205497 | 0.84 | TSHR (0.31) | TSHRALDH1A1CYP3A4TP53HIF1A | |
| SCHEMBL5206233 | 0.82 | TSHR (0.33) | TSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL5204315 | 0.81 | TSHR (0.38) | TSHRALDH1A1 | |
| SCHEMBL5209324 | 0.81 | ALDH1A1 (0.35) | TSHRALDH1A1CYP3A4 | |
| SCHEMBL5211519 | 0.81 | ALDH1A1 (0.35) | TSHRALDH1A1CYP3A4 | |
| SCHEMBL5210721 | 0.81 | ALDH1A1 (0.35) | TSHRALDH1A1CYP3A4 | |
| SCHEMBL5205330 | 0.80 | — | — | |
| SCHEMBL5209278 | 0.79 | THRB (0.33) | TSHRALDH1A1CYP3A4TP53HIF1A | |
| SCHEMBL5206839 | 0.76 | TSHR (0.31) | TSHRALDH1A1CYP3A4TP53HIF1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1388540-B1 | ACRYLIC ESTERS AND USE THEREOF | MITSUI CHEMICALS INC (JP) | 2007-09-05 | — | — | EP | disclosed |
| US-6835844-B2 | Acrylic esters and use thereof | MITSUI CHEMICALS, INC. (JP) | 2004-12-28 | — | — | US | disclosed |
| EP-1388540-A1 | ACRYLIC ESTERS AND USE THEREOF | Mitsui Chemicals, Inc. (JP) | 2004-02-11 | — | — | EP | disclosed |