Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | LIG1 | P18858 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | GSR | P00390 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Acrylic Acid Methyl Ester SCHEMBL28247748 | 0.87 | THRB (0.35) | ALDH1A1SMN1; SMN2HSD17B10LIG1AKT1 | |
| SCHEMBL28273783 | 0.85 | CYP3A4 (0.37) | CYP3A4ALDH1A1PKMSMN1; SMN2NPSR1 | |
| SCHEMBL7619608 | 0.84 | TSHR (0.50) | TSHRTDP1MAPTTHRB | |
| SCHEMBL1738983 | 0.80 | CYP3A4 (0.36) | CYP3A4ALDH1A1PKMSMN1; SMN2NPSR1 | |
| SCHEMBL28249302 | 0.80 | KDM4E (0.33) | CYP3A4ALDH1A1PKMSMN1; SMN2NPSR1 | |
| SCHEMBL15241 | 0.78 | TSHR (0.38) | ALDH1A1TSHR | |
| SCHEMBL27995843 | 0.78 | ALDH1A1 (0.39) | CYP3A4ALDH1A1GSRAKT1MEN1 | |
| SCHEMBL8148148 | 0.78 | THRB (0.40) | CYP3A4ALDH1A1PKMSMN1; SMN2HSD17B10 | |
| SCHEMBL347597 | 0.76 | TDP1 (0.61) | ALDH1A1SMN1; SMN2MAPK1TDP1KMT2A | |
| SCHEMBL8846804 | 0.75 | ALDH1A1 (0.56) | ALDH1A1PKMSMN1; SMN2MAPK1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160213891-A1 | Medical Dilation Element | ZAMORE, ALAN | 2016-07-28 | — | — | US | disclosed |
| US-6096794-A | PHOTOINITIATOR SYSTEM FOR PHOTOPOLYMERIZATION OF ETHYLENICALLY UNSATURATED POLYMERIZABLE COMPOUNDS | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2000-08-01 | — | — | US | disclosed |