Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21424047 | 0.85 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1BCHEPDK2NOTUM | |
| SCHEMBL23011862 | 0.85 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1BCHEPDK2NOTUM | |
| SCHEMBL30606195 | 0.81 | POLB (0.50) | SMN1; SMN2ALDH1A1BCHEPDK2GAA | |
| SCHEMBL28231420 | 0.81 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1BCHEPDK2GAA | |
| SCHEMBL30606201 | 0.80 | SMN1; SMN2 (0.49) | SMN1; SMN2ALDH1A1BCHEPDK2CHRNB2 | |
| SCHEMBL31391933 | 0.77 | BCHE (0.42) | SMN1; SMN2ALDH1A1BCHEPDK2GAA | |
| SCHEMBL29725489 | 0.77 | SMN1; SMN2 (0.57) | SMN1; SMN2ALDH1A1BCHEGAAMAPT | |
| SCHEMBL26553697 | 0.77 | SMN1; SMN2 (0.41) | SMN1; SMN2ALDH1A1BCHEPDK2GAA | |
| SCHEMBL8351549 | 0.77 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1MEN1KMT2AHSD17B10 | |
| SCHEMBL28650406 | 0.76 | ALDH1A1 (0.51) | SMN1; SMN2ALDH1A1BCHEPDK2GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117693509-A | Macrocyclic compounds for the treatment of cancer | 豪夫迈·罗氏有限公司 | 2024-03-12 | — | — | CN | claimed |
| CN-117693509-A | Macrocyclic compounds for the treatment of cancer | 豪夫迈·罗氏有限公司 | 2024-03-12 | — | — | CN | disclosed |