Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | NHERF1 | O14745 | 1/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.48 |
| ▸ | PDE2A | O00408 | 1/20 | 0.46 |
| ▸ | PDE5A | O76074 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL452351 | 1.00 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL10453008 | 0.87 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL10453009 | 0.87 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL1817485 | 0.85 | HSD17B10 (0.60) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL31518627 | 0.85 | HSD17B10 (0.60) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL5075923 | 0.84 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL9838827 | 0.84 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL390493 | 0.84 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL2483870 | 0.84 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL7769137 | 0.84 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 |
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-3966208-A2 | COMPOUNDS AND METHODS FOR TREATING CANCER | Antidote IP Holdings, LLC (US) | 2022-03-16 | — | — | EP | disclosed |