Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | EPAS1 | Q99814 | 8/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | IP6K1 | Q92551 | 3/20 | 0.32 |
| ▸ | IP6K3 | Q96PC2 | 2/20 | 0.32 |
| ▸ | IP6K2 | Q9UHH9 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | FBP1 | P09467 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31001160 | 0.75 | ALDH1A1 (0.46) | ALDH1A1KDM4EHSD17B10MAPTHPGD | |
| SCHEMBL30987223 | 0.75 | MAPT (0.60) | ALDH1A1KDM4EHSD17B10MAPTEPAS1 | |
| SCHEMBL28563540 | 0.75 | MAPT (0.60) | ALDH1A1KDM4EHSD17B10MAPTEPAS1 | |
| SCHEMBL6691319 | 0.70 | ALDH1A1 (0.55) | ALDH1A1KDM4EHSD17B10MAPTHPGD | |
| SCHEMBL16563217 | 0.70 | ALDH1A1 (0.30) | ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL2492556 | 0.69 | ALDH1A1 (0.62) | ALDH1A1KDM4EHSD17B10MAPTHPGD | |
| SCHEMBL6964514 | 0.69 | KDM4E (0.52) | ALDH1A1KDM4EHSD17B10MAPTEPAS1 | |
| SCHEMBL19358934 | 0.67 | KDM4E (0.46) | ALDH1A1KDM4EHSD17B10MAPTEPAS1 | |
| SCHEMBL29633947 | 0.67 | GPR3 (0.42) | ALDH1A1KDM4EHSD17B10MAPTHPGD | |
| SCHEMBL13700942 | 0.66 | ELANE (0.58) | ALDH1A1KDM4EMAPTHPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109535155-B | Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases | 艾伯维公司 | 2022-07-12 | — | — | CN | disclosed |