Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL57687 | 0.94 | THRB (0.43) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL57689 | 0.89 | THRB (0.43) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL8551749 | 0.88 | THRB (0.46) | TSHRALDH1A1CYP3A4THRBAPP | |
| SCHEMBL10391374 | 0.82 | TSHR (0.49) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL29448438 | 0.82 | TSHR (0.47) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL29597270 | 0.81 | THRB (0.49) | TSHRALDH1A1CYP3A4THRBAPP | |
| SCHEMBL28390939 | 0.81 | THRB (0.42) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL29487385 | 0.80 | TSHR (0.49) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL1265100 | 0.80 | TSHR (0.49) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL23881987 | 0.80 | THRB (0.43) | TSHRALDH1A1CYP3A4THRBHPGD |
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-0572269-A1 | Fluorine containing aqueous composition having water repellent and oil repellent properties | HOECHST GOSEI K.K. (JP) | 1993-12-01 | — | — | EP | disclosed |