Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.71 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.71 |
| ▸ | PKM | P14618 | 2/20 | 0.71 |
| ▸ | HPGD | P15428 | 2/20 | 0.71 |
| ▸ | NPC1 | O15118 | 1/20 | 0.71 |
| ▸ | RAB9A | P51151 | 1/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.71 |
| ▸ | AURKA | O14965 | 1/20 | 0.66 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.61 |
| ▸ | METAP1 | P53582 | 2/20 | 0.54 |
| ▸ | MMP2 | P08253 | 3/20 | 0.53 |
| ▸ | MMP9 | P14780 | 3/20 | 0.53 |
| ▸ | MMP8 | P22894 | 3/20 | 0.53 |
| ▸ | MMP13 | P45452 | 3/20 | 0.53 |
| ▸ | METAP2 | P50579 | 1/20 | 0.53 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.51 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5591256 | 1.00 | ALDH1A1 (0.71) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL23132042 | 0.87 | ALDH1A1 (0.54) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL16332640 | 0.83 | ALDH1A1 (1.00) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL21565901 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL16331618 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL7437914 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL9694046 | 0.83 | ALDH1A1 (1.00) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL6245632 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL3331253 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4EPKMHPGDNPC1 | |
| SCHEMBL5590969 | 0.82 | ALDH1A1 (0.97) | ALDH1A1KDM4EPKMHPGDNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4110777-A1 | PYRROLOPYRIDINE AND IMIDAZOPYRIDINE ANTIVIRAL COMPOUNDS | Katholieke Universiteit Leuven, K.U.Leuven R&D (BE) | 2023-01-04 | — | — | EP | disclosed |