Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | VCP | P55072 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8346767 | 0.91 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8349021 | 0.89 | L3MBTL1 (0.49) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8347977 | 0.89 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8348056 | 0.89 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8349062 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8347307 | 0.87 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8348289 | 0.87 | MEN1 (0.38) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8348268 | 0.87 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8348315 | 0.85 | HPGD (0.44) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8346469 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2AL3MBTL1GAA |
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-2003053437-A1 | TRIAZOLES AS OXYTOCIN ANTAGONISTS | APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) | 2003-07-03 | — | — | WO | disclosed |