Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.72 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.72 |
| ▸ | CA2 | P00918 | 4/20 | 0.72 |
| ▸ | TYR | P14679 | 2/20 | 0.72 |
| ▸ | POLB | P06746 | 1/20 | 0.72 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.55 |
| ▸ | MIF | P14174 | 1/20 | 0.55 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.55 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11714536 | 0.92 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| SCHEMBL270433 | 0.92 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| SCHEMBL29359626 | 0.92 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| Methane SCHEMBL27527037 | 0.90 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| SCHEMBL11673542 | 0.90 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| SCHEMBL28427877 | 0.90 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| SCHEMBL11865746 | 0.90 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| Methane SCHEMBL28298729 | 0.90 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| SCHEMBL27638861 | 0.90 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CA2TYRPOLB | |
| SCHEMBL27637552 | 0.90 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CA2TYRPOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115461897-A | Dispersant composition for electrochemical device, conductive material dispersion liquid for electrochemical device, slurry for electrochemical device electrode, electrode for electrochemical device, and electrochemical device | 日本瑞翁株式会社 | 2022-12-09 | — | — | CN | disclosed |
| US-5500425-A | Chroman derivatives and a method of treating 5-HT mediated disorders | AKTIEBOLAGET ASTRA (SE) | 1996-03-19 | — | — | US | disclosed |