Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 4/20 | 0.37 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5958030 | 0.95 | ESR1 (0.41) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL27634820 | 0.87 | LMNA (0.39) | TSHRMAPK1ALDH1A1NPC1RAB9A | |
| SCHEMBL29130134 | 0.82 | TSHR (0.51) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL3283312 | 0.81 | TSHR (0.53) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL6570040 | 0.80 | DGAT1 (0.49) | TSHRCYP3A4ALDH1A1NPC1MAPT | |
| SCHEMBL1312058 | 0.79 | ALDH1A1 (0.64) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL3262610 | 0.78 | ALDH1A1 (0.67) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL3225675 | 0.78 | ALDH1A1 (0.67) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL1310680 | 0.78 | ALDH1A1 (0.67) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL3221420 | 0.78 | ALDH1A1 (0.67) | TSHRMAPK1TP53CYP3A4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1729159-A | Amide compounds and methods for controlling plant diseases | SUMITOMO CHEMICAL CO (JP) | 2006-02-01 | — | — | CN | disclosed |