Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | IDO1 | P14902 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CD44 | P16070 | 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 | |
|---|---|---|---|---|
| SCHEMBL8065484 | 0.81 | CYP3A4 (0.42) | CYP3A4TSHRPIK3CATDP1TP53 | |
| SCHEMBL2776271 | 0.79 | ALDH1A1 (0.40) | CYP3A4TSHRPIK3CATDP1TP53 | |
| SCHEMBL17998039 | 0.77 | CYP3A4 (0.39) | CYP3A4TSHRPIK3CATDP1TP53 | |
| SCHEMBL8535795 | 0.74 | NOS3 (0.34) | ALDH1A1POLB | |
| SCHEMBL3425610 | 0.74 | GABRA1 (0.38) | CYP3A4TSHRPIK3CATDP1TP53 | |
| SCHEMBL263814 | 0.73 | TDP1 (0.32) | CYP3A4TSHRTDP1TP53ALOX15 | |
| SCHEMBL10342533 | 0.72 | SKP2 (0.47) | CYP3A4TSHRPIK3CATDP1TP53 | |
| SCHEMBL2934547 | 0.72 | CYP3A4 (0.53) | CYP3A4TSHRPIK3CATDP1TP53 | |
| SCHEMBL10845366 | 0.71 | HTR2A (0.41) | CYP3A4TSHRPIK3CAALOX15ALDH1A1 | |
| SCHEMBL8063101 | 0.71 | CYP3A4 (0.48) | CYP3A4TSHRTDP1SMN1; SMN2ALDH1A1 |
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-0591059-B1 | Use of sulfur-containing metaphenylenediamines for dyeing keratinic fibers and new sulfur-containing metaphenylenediamines | OREAL (FR) | 1998-04-15 | — | — | EP | claimed |
| CN-108474968-A | The manufacturing method and eyeglass of eyeglass | 豪雅镜片泰国有限公司 | 2018-08-31 | — | — | CN | disclosed |