Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 2/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | LDHA | P00338 | 1/20 | 0.36 |
| ▸ | LDHB | P07195 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12822356 | 1.00 | IDH1 (0.44) | IDH1HSP90AA1TBXAS1DAOSRD5A2 | |
| SCHEMBL12822344 | 0.87 | MAOA (0.50) | IDH1HSP90AA1TBXAS1DAOSRD5A2 | |
| SCHEMBL12760719 | 0.87 | MAOA (0.50) | IDH1HSP90AA1TBXAS1DAOSRD5A2 | |
| SCHEMBL29906394 | 0.87 | MAOA (0.50) | IDH1HSP90AA1TBXAS1DAOSRD5A2 | |
| SCHEMBL12833645 | 0.87 | TBXAS1 (0.54) | IDH1HSP90AA1TBXAS1CHRM5CHRM3 | |
| SCHEMBL12965472 | 0.86 | CHRM5 (0.47) | IDH1HSP90AA1TBXAS1DAOSRD5A2 | |
| SCHEMBL12822367 | 0.86 | ACHE (0.41) | IDH1HSP90AA1TBXAS1ACHEKIF11 | |
| SCHEMBL12822037 | 0.86 | CHRM5 (0.47) | IDH1HSP90AA1TBXAS1DAOSRD5A2 | |
| SCHEMBL12822280 | 0.85 | ESR1 (0.42) | IDH1HSP90AA1TBXAS1SRD5A2LDHA | |
| SCHEMBL15700245 | 0.85 | P2RX3 (0.42) | IDH1HSP90AA1TBXAS1CHRM5CHRM3 |
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-2022184904-A1 | PHOTOREDOX RADICAL BENZYLATION PROCESS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2022-09-09 | — | — | WO | disclosed |