Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL29755947 | 0.84 | MAOA (0.44) | ALDH1A1CYP3A4TDP1HSD17B10MEN1 | |
| SCHEMBL29638163 | 0.81 | HSD17B10 (0.48) | ALDH1A1CYP3A4TDP1HSD17B10MEN1 | |
| SCHEMBL16178332 | 0.81 | HSD17B10 (0.48) | ALDH1A1CYP3A4TDP1HSD17B10MEN1 | |
| SCHEMBL10608496 | 0.80 | HSD17B10 (0.48) | ALDH1A1CYP3A4TDP1HSD17B10MAPT | |
| SCHEMBL29756035 | 0.78 | TDP1 (0.46) | ALDH1A1CYP3A4TDP1TP53HSD17B10 | |
| SCHEMBL18889618 | 0.78 | TDP1 (0.46) | ALDH1A1CYP3A4TDP1TP53HSD17B10 | |
| SCHEMBL2446270 | 0.77 | CYP3A4 (0.50) | ALDH1A1CYP3A4TDP1TP53HSD17B10 | |
| SCHEMBL1263497 | 0.76 | PTGS2 (0.44) | ALDH1A1TDP1HSD17B10MEN1MAPT | |
| SCHEMBL6020612 | 0.75 | CYP3A4 (0.62) | ALDH1A1CYP3A4TDP1TP53HSD17B10 | |
| SCHEMBL1838859 | 0.75 | HSD17B10 (0.48) | ALDH1A1CYP3A4TDP1HSD17B10MAPT |
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-108911992-A | A kind of Triamine monomer and its preparation method and application | 湖南工业大学 | 2018-11-30 | — | — | CN | disclosed |