Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | CHKA | P35790 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL27472061 | 0.95 | ALDH1A1 (0.50) | ALDH1A1SLC6A2SLC6A4SLC6A3PDE10A | |
| Quinoline SCHEMBL27925785 | 0.93 | ALDH1A1 (0.49) | ALDH1A1SLC6A2SLC6A4SLC6A3PDE10A | |
| Quinoline SCHEMBL27749698 | 0.92 | ALDH1A1 (0.45) | ALDH1A1SLC6A2SLC6A4SLC6A3PDE10A | |
| Quinoline SCHEMBL28233004 | 0.89 | ALDH1A1 (0.41) | ALDH1A1SLC6A2SLC6A4SLC6A3PDE10A | |
| Quinoline SCHEMBL27814336 | 0.87 | ALDH1A1 (0.42) | ALDH1A1SLC6A2SLC6A4SLC6A3CHKA | |
| Phthalic Acid SCHEMBL28052493 | 0.87 | CHRM5 (0.42) | ALDH1A1SMN1; SMN2KDM4EHTTCYP3A4 | |
| Quinoline SCHEMBL27860538 | 0.86 | ALDH1A1 (0.41) | ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E | |
| Quinoline SCHEMBL27939604 | 0.85 | ALDH1A1 (0.49) | ALDH1A1SLC6A2SLC6A4SLC6A3PDE10A | |
| Quinoline SCHEMBL28849626 | 0.85 | ALDH1A1 (0.38) | ALDH1A1PDE10ACHKASMN1; SMN2KDM4E | |
| Quinoline SCHEMBL27584551 | 0.83 | ALDH1A1 (0.46) | ALDH1A1SLC6A2SLC6A4SLC6A3NPC1 |
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-105838350-A | Electrochromic composite material and prepared electrochromic device | 吉林大学 | 2016-08-10 | — | — | CN | disclosed |