Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5209119 | 0.85 | ALDH1A1 (0.36) | TSHRALDH1A1THRB | |
| SCHEMBL5204398 | 0.85 | ALDH1A1 (0.44) | TSHRALDH1A1THRB | |
| SCHEMBL5206348 | 0.82 | ALDH1A1 (0.42) | TSHRALDH1A1 | |
| SCHEMBL5212211 | 0.82 | ALDH1A1 (0.42) | TSHRALDH1A1 | |
| SCHEMBL5205738 | 0.81 | TSHR (0.41) | TSHRALDH1A1 | |
| SCHEMBL5212486 | 0.81 | ALDH1A1 (0.41) | TSHRALDH1A1 | |
| SCHEMBL5210304 | 0.81 | ALDH1A1 (0.41) | TSHRALDH1A1 | |
| SCHEMBL5210377 | 0.81 | ALDH1A1 (0.41) | TSHRALDH1A1 | |
| SCHEMBL5210118 | 0.80 | — | — | |
| SCHEMBL5210062 | 0.79 | CA1 (0.33) | TSHRALDH1A1THRBPOLBAPEX1 |
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 |