Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23909017 | 0.83 | SMN1; SMN2 (0.66) | ALDH1A1KDM4EHSD17B10SMN1; SMN2CYP1A2 | |
| SCHEMBL23914670 | 0.80 | SMN1; SMN2 (0.48) | ALDH1A1KDM4ESMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL1989361 | 0.79 | SMN1; SMN2 (0.72) | ALDH1A1KDM4EHSD17B10SMN1; SMN2LMNA | |
| SCHEMBL23908935 | 0.77 | LMNA (0.62) | ALDH1A1KDM4ESMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL21591507 | 0.73 | CYP1A2 (0.58) | ALDH1A1KDM4ESMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL8766823 | 0.73 | ALDH1A1 (0.79) | ALDH1A1KDM4EHSD17B10SMN1; SMN2HPGD | |
| SCHEMBL4300704 | 0.73 | SMN1; SMN2 (0.71) | ALDH1A1KDM4EHSD17B10SMN1; SMN2MAPT | |
| SCHEMBL11133828 | 0.72 | ALDH1A1 (0.46) | ALDH1A1KDM4EHSD17B10SMN1; SMN2HPGD | |
| SCHEMBL5010738 | 0.69 | SMN1; SMN2 (1.00) | ALDH1A1KDM4EHSD17B10SMN1; SMN2TSHR | |
| SCHEMBL3716680 | 0.69 | KDM4E (0.81) | ALDH1A1KDM4EHSD17B10SMN1; SMN2CYP1A2 |
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-3649119-B1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS | GALAPAGOS NV (BE) | 2021-11-03 | — | — | EP | disclosed |