Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.36 |
| ▸ | ALPI | P09923 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.36 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.36 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 3/20 | 0.35 |
| ▸ | PPARA | Q07869 | 3/20 | 0.35 |
| ▸ | CPA1 | P15085 | 3/20 | 0.34 |
| ▸ | CPA3 | P15088 | 2/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.34 |
| ▸ | CPB1 | P15086 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2793995 | 0.78 | CES2 (0.38) | THRBALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7895052 | 0.72 | ALDH1A1 (0.42) | CYP1A2THRBALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL16486014 | 0.70 | CYP1A2 (0.46) | CYP1A2THRBSRRALPIPKM | |
| SCHEMBL2794004 | 0.70 | ALDH1A1 (0.40) | CYP1A2THRBALDH1A1CYP2C19 | |
| SCHEMBL9646933 | 0.69 | CTSK (0.47) | CYP1A2THRBSRRALPIPKM | |
| SCHEMBL961985 | 0.69 | CYP1A2 (0.44) | CYP1A2THRBSRRALPIPKM | |
| SCHEMBL28354512 | 0.69 | THRB (0.46) | CYP1A2THRBSRRALPIPKM | |
| SCHEMBL7895046 | 0.69 | ALDH1A1 (0.44) | CYP1A2THRBALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL8524280 | 0.68 | HCAR2 (0.47) | THRBALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL351499 | 0.68 | THRB (0.45) | THRBPKMALDH1A1CYP3A4CYP2C19 |
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-6184323-B1 | FOR OPHTHALMIC LENSES | ESSILOR INTERNATIONAL-COMPAGNIE GENERALE D'OPTIQUE (FR) | 2001-02-06 | — | — | US | disclosed |