Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 3/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 0.35 |
| ▸ | SPHK2 | Q9NRA0 | 3/20 | 0.35 |
| ▸ | GUSB | P08236 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL548102 | 0.81 | EPHX1 (0.39) | ALDH1A1EPHX1S1PR1S1PR3ALOX5 | |
| SCHEMBL11033685 | 0.78 | ALDH1A1 (0.41) | ALDH1A1EPHX1ALOX5TSHRTHRB | |
| SCHEMBL16765710 | 0.78 | TDP1 (0.40) | ALDH1A1EPHX1S1PR1S1PR3ALOX5 | |
| SCHEMBL16765708 | 0.78 | TDP1 (0.40) | ALDH1A1EPHX1S1PR1S1PR3ALOX5 | |
| SCHEMBL17351132 | 0.77 | ALDH1A1 (0.41) | ALDH1A1EPHX1TSHRTHRBGBA1 | |
| Ammonia Solution, Strong SCHEMBL22283017 | 0.76 | ALDH1A1 (0.39) | ALDH1A1EPHX1ALOX5TSHRTHRB | |
| SCHEMBL16765715 | 0.75 | TDP1 (0.41) | ALDH1A1EPHX1S1PR1S1PR3 | |
| SCHEMBL11859588 | 0.74 | ALDH1A1 (0.43) | ALDH1A1EPHX1S1PR1S1PR3ALOX5 | |
| SCHEMBL1784652 | 0.74 | ALDH1A1 (0.34) | ALDH1A1GBA1 | |
| SCHEMBL1784655 | 0.74 | ALDH1A1 (0.34) | ALDH1A1GBA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020193650-A1 | PROCESS FOR PREPARING 1,2-ENDOPEROXIDE COMPOUNDS | Universite Paris-Saclay (FR) | 2020-10-01 | — | — | WO | disclosed |