Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 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 | |
|---|---|---|---|---|
| SCHEMBL7772046 | 0.88 | SLC6A4 (0.42) | SMN1; SMN2LMNAL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL7773934 | 0.88 | SLC6A4 (0.42) | SMN1; SMN2LMNAL3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL8552624 | 0.87 | CYP19A1 (0.47) | CYP17A1SMN1; SMN2ALDH1A1CYP3A4CYP19A1 | |
| SCHEMBL8109544 | 0.87 | SMN1; SMN2 (0.44) | CYP17A1SMN1; SMN2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8552459 | 0.86 | CYP17A1 (0.44) | CYP17A1CYP3A4CYP19A1 | |
| SCHEMBL8551073 | 0.85 | MAPK1 (0.47) | SMN1; SMN2LMNAL3MBTL1SLC6A2SLC6A3 | |
| SCHEMBL8133883 | 0.85 | CYP17A1 (0.40) | CYP17A1SMN1; SMN2LMNAL3MBTL1SLC6A2 | |
| SCHEMBL8551928 | 0.84 | CYP11B1 (0.43) | SMN1; SMN2LMNAALDH1A1ALOX15HSD17B10 | |
| SCHEMBL8550686 | 0.82 | KCNA5 (0.43) | CYP17A1SLC6A4CYP3A4CYP3A5CYP19A1 | |
| SCHEMBL8550029 | 0.82 | CYP19A1 (0.47) | CYP17A1ALDH1A1HPGDCYP3A4CYP19A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0865431-A2 | COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1998-09-23 | — | — | EP | disclosed |
| WO-1997020815-A1 | COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1997-06-12 | — | — | WO | disclosed |