Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.61 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL820321 | 0.89 | RPS6KA3 (0.47) | ALDH1A1TDP1CYP3A4TSHRRPS6KA3 | |
| SCHEMBL5437684 | 0.87 | RPS6KA3 (0.46) | ALDH1A1TDP1CYP3A4TSHRRPS6KA3 | |
| Hydrochloric Acid SCHEMBL27683817 | 0.87 | RPS6KA3 (0.46) | ALDH1A1TDP1CYP3A4TSHRRPS6KA3 | |
| Methane SCHEMBL28199914 | 0.87 | RPS6KA3 (0.46) | ALDH1A1TDP1CYP3A4TSHRRPS6KA3 | |
| SCHEMBL5437685 | 0.87 | RPS6KA3 (0.46) | ALDH1A1TDP1CYP3A4TSHRRPS6KA3 | |
| SCHEMBL29006686 | 0.86 | ALDH1A1 (0.42) | ALDH1A1TDP1CYP3A4TSHRRPS6KA3 | |
| Orthotolidine SCHEMBL9405146 | 0.82 | CYP3A4 (0.81) | ALDH1A1TDP1CYP3A4TSHRCASP1 | |
| SCHEMBL8953924 | 0.82 | CYP3A4 (0.81) | ALDH1A1TDP1CYP3A4TSHRCASP1 | |
| SCHEMBL99565 | 0.82 | CYP3A4 (0.81) | ALDH1A1TDP1CYP3A4TSHRCASP1 | |
| SCHEMBL29742298 | 0.82 | CYP3A4 (0.81) | ALDH1A1TDP1CYP3A4TSHRCASP1 |
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-117624596-A | Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal display element and manufacturing method thereof | 日产化学株式会社 | 2024-03-01 | — | — | CN | disclosed |