Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HNF4A | P41235 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.41 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL11543264 | 0.77 | ALDH1A1 (0.90) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A | |
| SCHEMBL12114030 | 0.77 | ALDH1A1 (0.77) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A | |
| SCHEMBL4308381 | 0.76 | ALDH1A1 (0.47) | ALDH1A1TDP1KMT2APOLBL3MBTL1 | |
| SCHEMBL116566 | 0.75 | ALDH1A1 (1.00) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A | |
| SCHEMBL29687907 | 0.75 | ALDH1A1 (1.00) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A | |
| SCHEMBL2588443 | 0.75 | ALDH1A1 (0.72) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A | |
| SCHEMBL20307420 | 0.74 | ALDH1A1 (0.54) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A | |
| SCHEMBL20830626 | 0.74 | ALDH1A1 (0.54) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A | |
| SCHEMBL12114034 | 0.74 | ALDH1A1 (0.57) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A | |
| SCHEMBL4314829 | 0.74 | KMT2A (0.68) | ALDH1A1TDP1SLC6A2SLC6A3KMT2A |
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-2009136001-A1 | PROTEIN KINASE MODULATING AGENTS | TUOMINEN RAIMO (FI) | 2009-11-12 | — | — | WO | disclosed |