Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 6/20 | 0.41 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.41 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16384955 | 0.90 | TSHR (0.70) | TSHRALDH1A1CYP3A4HPGDEPHX2 | |
| SCHEMBL13051497 | 0.88 | TSHR (0.52) | TSHRALDH1A1CYP3A4HPGDEPHX2 | |
| SCHEMBL22196862 | 0.88 | ACHE (0.50) | TSHRALDH1A1CYP3A4HPGDEPHX2 | |
| SCHEMBL16384932 | 0.86 | TSHR (0.63) | TSHRALDH1A1CYP3A4HPGDEPHX1 | |
| SCHEMBL12570765 | 0.83 | TSHR (0.59) | TSHRALDH1A1CYP3A4HPGDEPHX2 | |
| SCHEMBL8028192 | 0.83 | EPHX1 (0.59) | TSHRALDH1A1CYP3A4HPGDEPHX2 | |
| SCHEMBL13032966 | 0.83 | EPHX1 (0.59) | TSHRALDH1A1CYP3A4HPGDEPHX2 | |
| SCHEMBL30121582 | 0.83 | EPHX1 (0.59) | TSHRALDH1A1CYP3A4HPGDEPHX2 | |
| SCHEMBL30121581 | 0.83 | EPHX1 (0.59) | TSHRALDH1A1CYP3A4HPGDEPHX2 | |
| SCHEMBL30121679 | 0.83 | EPHX1 (0.59) | TSHRALDH1A1CYP3A4HPGDEPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2918259-A1 | Dental composition based on condensed aromatic compounds | DENTSPLY DETREY GmbH (DE) | 2015-09-16 | — | — | EP | disclosed |