Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | FNTA | P49354 | 3/20 | 0.47 |
| ▸ | FNTB | P49356 | 3/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL31596236 | 1.00 | ALDH1A1 (0.54) | ALDH1A1POLBKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL30541505 | 0.97 | ALDH1A1 (0.59) | ALDH1A1POLBKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL27722718 | 0.95 | ALDH1A1 (0.62) | ALDH1A1POLBKMT2AMEN1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1532689 | 0.94 | ALDH1A1 (0.60) | ALDH1A1POLBKMT2AMEN1SMN1; SMN2 | |
| Oxalic Acid SCHEMBL5266041 | 0.91 | ALDH1A1 (0.57) | ALDH1A1POLBKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL1652022 | 0.88 | FNTA (0.46) | ALDH1A1POLBKMT2ASMN1; SMN2NPSR1 | |
| SCHEMBL3484927 | 0.86 | FNTA (0.50) | KMT2AFNTAFNTBMGLL | |
| SCHEMBL12271108 | 0.86 | MKNK1 (0.52) | ALDH1A1POLBKMT2ASMN1; SMN2FNTA | |
| SCHEMBL29988703 | 0.86 | MKNK1 (0.52) | ALDH1A1POLBKMT2ASMN1; SMN2FNTA | |
| Hydrochloric Acid SCHEMBL1532934 | 0.85 | MKNK1 (0.51) | ALDH1A1KMT2AFNTAFNTBALOX15 |
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-4208456-A1 | HETEROCYCLIC COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2023-07-12 | — | — | EP | disclosed |