Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | GLS | O94925 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9026489 | 0.96 | SLC6A3 (0.39) | ALDH1A1CYP3A4SLC6A3KDM4EPKM | |
| SCHEMBL9025789 | 0.94 | SLC6A3 (0.37) | ALDH1A1CYP3A4SLC6A3KDM4EPKM | |
| SCHEMBL14962416 | 0.85 | SLC6A3 (0.41) | ALDH1A1SLC6A3KDM4EPKMSMN1; SMN2 | |
| SCHEMBL14962415 | 0.82 | SLC6A3 (0.39) | CYP3A4SLC6A3KDM4EPKMHSD17B10 | |
| SCHEMBL14962413 | 0.82 | SLC6A3 (0.39) | CYP3A4SLC6A3KDM4EPKMHSD17B10 | |
| SCHEMBL8634186 | 0.81 | MEN1 (0.41) | P2RX7 | |
| SCHEMBL14962414 | 0.81 | SLC6A3 (0.38) | ALDH1A1SLC6A3KDM4EPKMSMN1; SMN2 | |
| SCHEMBL9025932 | 0.80 | SLC6A3 (0.42) | SLC6A3KDM4EPKMSMN1; SMN2TSHR | |
| SCHEMBL12180158 | 0.78 | SLC6A3 (0.39) | SLC6A3KDM4EPKMSMN1; SMN2TSHR | |
| SCHEMBL14962409 | 0.76 | SLC6A3 (0.40) | ALDH1A1SLC6A3KDM4EPKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5712299-A | TREATMENT OF NEURODEGENERATIVE DISORDERS | ASTRA AKTIEBOLAG (SE) | 1998-01-27 | — | — | US | disclosed |
| EP-0707574-A1 | NOVEL (1-PHENYL-1-HETEROCYCLYL)METHANOL AND (1-PHENYL-1-HETEROCYCLYL)METHYLAMINE DERIVATIVES | Astra Aktiebolag (SE) | 1996-04-24 | — | — | EP | disclosed |
| WO-1995001968-A1 | NOVEL (1-PHENYL-1-HETEROCYCLYL)METHANOL AND (1-PHENYL-1-HETEROCYCLYL)METHYLAMINE DERIVATIVES | ASTRA AKTIEBOLAG (SE) | 1995-01-19 | — | — | WO | disclosed |