Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | THRB | P10828 | 1/20 | 0.51 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 3/20 | 0.37 |
| ▸ | FAAH | O00519 | 2/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL11252637 | 1.00 | ALDH1A1 (0.51) | ALDH1A1GAAMAPTTHRBGBA1 | |
| SCHEMBL11257124 | 0.91 | ALDH1A1 (0.49) | ALDH1A1GAAMAPTTHRBGBA1 | |
| SCHEMBL11257126 | 0.91 | ALDH1A1 (0.49) | ALDH1A1GAAMAPTTHRBGBA1 | |
| SCHEMBL11259515 | 0.89 | THRB (0.41) | ALDH1A1GAAMAPTTHRBGBA1 | |
| SCHEMBL11128278 | 0.86 | ALDH1A1 (0.41) | ALDH1A1GAAMAPTTHRB | |
| SCHEMBL11130692 | 0.86 | ALDH1A1 (0.41) | ALDH1A1GAAMAPTTHRB | |
| SCHEMBL11264796 | 0.86 | ALDH1A1 (0.41) | ALDH1A1GAAMAPTTHRB | |
| SCHEMBL11271410 | 0.85 | ALDH1A1 (0.40) | ALDH1A1GAAMAPTTHRB | |
| SCHEMBL11268114 | 0.84 | MGLL (0.43) | ALDH1A1GAAMAPTTHRBMGLL | |
| SCHEMBL11268119 | 0.84 | MGLL (0.43) | ALDH1A1GAAMAPTTHRBMGLL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-55136268-A | — | — | None | — | — | JP | disclosed |
| US-4346087-A | CORROSION RESISTANCE | TOHO CHEMICAL INDUSTRY CO., LTD. (JP) | 1982-08-24 | — | — | US | disclosed |
| JP-S55136268-A | AZALKENELACTAM HAVING LONG CHAIN HYDROCARBON GROUP, ITS BETAINE FORM, THEIR PREPARATION, AND GERMICIDES AND METAL-CORROSION INHIBITOR CONTAINING THE SAME | TOHO CHEM IND CO LTD | 1980-10-23 | — | — | JP | disclosed |