Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.34 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL14443187 | 0.74 | ALDH1A1 (0.43) | ALDH1A1GAAHPGDCYP3A4ALOX15 | |
| SCHEMBL8323969 | 0.74 | SLC6A2 (0.45) | ALDH1A1GAACYP3A4ALOX15ALOX5 | |
| SCHEMBL8146532 | 0.73 | ALDH1A1 (0.54) | ALDH1A1GAAHPGDCYP3A4ALOX15 | |
| SCHEMBL13281142 | 0.73 | GAA (0.40) | ALDH1A1GAAHPGDUSP2TDP1 | |
| SCHEMBL385865 | 0.73 | ALDH1A1 (0.44) | ALDH1A1GAAHPGDCYP3A4ALOX15 | |
| SCHEMBL11118607 | 0.72 | GAA (0.42) | ALDH1A1GAAHPGDCYP3A4ALOX15 | |
| SCHEMBL11419923 | 0.71 | ALDH1A1 (0.41) | ALDH1A1GAAHPGDCYP3A4ALOX15 | |
| SCHEMBL385593 | 0.70 | S1PR1 (0.40) | ALDH1A1CYP3A4ALOX15ALOX5KMT2A | |
| SCHEMBL592514 | 0.70 | — | — | |
| SCHEMBL8570960 | 0.70 | CHRM2 (0.45) | ALDH1A1GAAHPGDCYP3A4ALOX15 |
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-4276092-A1 | COMPOUND LIBRARY | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2023-11-15 | — | — | EP | disclosed |