Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29713571 | 1.00 | MAPK1 (0.56) | MAPK1CA1CA2CYP1B1ALDH1A1 | |
| SCHEMBL28708191 | 0.81 | MAPT (0.53) | ALDH1A1KDM4EHSD17B10SMN1; SMN2MAPT | |
| SCHEMBL29713565 | 0.81 | MAPT (0.53) | ALDH1A1KDM4EHSD17B10SMN1; SMN2MAPT | |
| SCHEMBL28708222 | 0.78 | MAPT (0.50) | ALDH1A1KDM4ESMN1; SMN2MAPTTP53 | |
| SCHEMBL28717714 | 0.78 | HSPA1A (0.45) | ALDH1A1KDM4ESMN1; SMN2MAPTTP53 | |
| SCHEMBL28704582 | 0.73 | CASP3 (0.44) | ALDH1A1KDM4EHSD17B10SMN1; SMN2MAPT | |
| SCHEMBL29713564 | 0.73 | KMT2A (0.41) | ALDH1A1KDM4EPOLBNPC1RAB9A | |
| SCHEMBL28721964 | 0.73 | KMT2A (0.41) | ALDH1A1KDM4EPOLBNPC1RAB9A | |
| SCHEMBL4747714 | 0.72 | MAPK1 (0.39) | MAPK1ALDH1A1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL10205853 | 0.71 | SQOR (0.51) | ALDH1A1KDM4ESMN1; SMN2MAPTL3MBTL1 |
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-113480533-B | Preparation method of 3, 4-pyridine diimides derivatives | 赣南师范大学 | 2022-08-02 | — | — | CN | disclosed |
| CN-113480533-A | Preparation method of 3, 4-pyridine diimides derivatives | 赣南师范大学 | 2021-10-08 | — | — | CN | disclosed |