Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL5209498 | 0.87 | ALDH1A1 (0.40) | ALDH1A1HTTTSHRTDP1 | |
| SCHEMBL5209616 | 0.85 | ALDH1A1 (0.37) | ALDH1A1HTT | |
| SCHEMBL5206729 | 0.85 | ALDH1A1 (0.37) | ALDH1A1HTT | |
| SCHEMBL5205341 | 0.83 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL5209658 | 0.82 | ALDH1A1 (0.39) | ALDH1A1HTT | |
| SCHEMBL5209862 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TSHR | |
| SCHEMBL5210023 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TSHR | |
| SCHEMBL5206617 | 0.81 | THRB (0.37) | — | |
| SCHEMBL7041104 | 0.81 | ALDH1A1 (0.39) | ALDH1A1HTTELANEHPGDALOX15 | |
| SCHEMBL5204333 | 0.80 | ALDH1A1 (0.40) | ALDH1A1HTTELANEHPGDALOX15 |
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 |