Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | SYK | P43405 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | FOS | P01100 | 1/20 | 0.53 |
| ▸ | JUN | P05412 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21160726 | 0.87 | ALDH1A1 (0.59) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL23967195 | 0.84 | ALDH1A1 (0.59) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL20875491 | 0.82 | ALDH1A1 (0.59) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL23126625 | 0.82 | ALDH1A1 (0.59) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL25829315 | 0.81 | ALDH1A1 (0.67) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL20658728 | 0.80 | ALDH1A1 (0.79) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL6631142 | 0.79 | ALDH1A1 (0.64) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL25828127 | 0.79 | ALDH1A1 (0.58) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL1521842 | 0.79 | ALDH1A1 (0.70) | ALDH1A1SYKMAPK1HTTMAPT | |
| SCHEMBL29545771 | 0.79 | ALDH1A1 (0.70) | ALDH1A1SYKMAPK1HTTMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125944-A1 | COMPOUND CONTAINING HETEROCYCLIC RING | 正大天晴药业集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |