Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.84 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.84 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.84 |
| ▸ | HPGD | P15428 | 3/20 | 0.84 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | ERN1 | O75460 | 8/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | APEX1 | P27695 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL1907716 | 1.00 | CYP3A4 (0.84) | CYP3A4TDP1ALDH1A1HPGDTRPA1 | |
| SCHEMBL14992 | 0.92 | CYP3A4 (1.00) | CYP3A4TDP1ALDH1A1HPGDTRPA1 | |
| SCHEMBL29350162 | 0.92 | CYP3A4 (1.00) | CYP3A4TDP1ALDH1A1HPGDTRPA1 | |
| SCHEMBL28869830 | 0.87 | ALDH1A1 (0.84) | CYP3A4TDP1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL5483295 | 0.87 | HPGD (0.90) | CYP3A4TDP1ALDH1A1HPGDTRPA1 | |
| SCHEMBL29800238 | 0.86 | CYP3A4 (0.71) | CYP3A4TDP1ALDH1A1HPGDTRPA1 | |
| SCHEMBL543088 | 0.86 | CYP3A4 (0.71) | CYP3A4TDP1ALDH1A1HPGDTRPA1 | |
| SCHEMBL1070288 | 0.85 | CYP3A4 (0.69) | CYP3A4TDP1ALDH1A1HPGDTRPA1 | |
| SCHEMBL8942826 | 0.83 | ALDH1A1 (0.61) | CYP3A4TDP1ALDH1A1HPGDTRPA1 | |
| SCHEMBL9776922 | 0.81 | CYP3A4 (0.63) | CYP3A4TDP1ALDH1A1HPGDTRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5480946-A | CONTACT LENSES | CIBA GEIGY CORPORATION (US) | 1996-01-02 | — | — | US | claimed |