Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMAD3 | P84022 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | BRCA1 | P38398 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GLB1 | P16278 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL235829 | 0.97 | SMAD3 (0.40) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL29461682 | 0.97 | SMAD3 (0.40) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL6045753 | 0.89 | ALDH1A1 (0.47) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL1022908 | 0.88 | SMAD3 (0.40) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL6816059 | 0.84 | SMAD3 (0.36) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL231207 | 0.82 | ALDH1A1 (0.58) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL29838734 | 0.81 | SMAD3 (0.35) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL29838717 | 0.81 | SMAD3 (0.35) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL5489541 | 0.81 | SMAD3 (0.35) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 | |
| SCHEMBL1444923 | 0.80 | SMAD3 (0.57) | SMAD3ALDH1A1HPGDBRCA1HSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005037210-A2 | PHOTOCLEAVABLE ISOTOPE-CODED AFFINITY TAGS | AMBERGEN, INC. (US) | 2005-04-28 | — | — | WO | disclosed |