Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20039905 | 0.83 | SLC6A2 (0.34) | SLC6A2SLC6A4SLC6A3ADORA3ESR1 | |
| SCHEMBL10028646 | 0.80 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3ADORA3ESR1 | |
| SCHEMBL18533959 | 0.80 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3ADORA3ESR1 | |
| SCHEMBL13539978 | 0.80 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3ADORA3ESR1 | |
| SCHEMBL21698332 | 0.80 | MAPT (0.35) | ALDH1A1L3MBTL1MAPTSMN1; SMN2 | |
| SCHEMBL8640292 | 0.79 | ESR1 (0.46) | SLC6A2SLC6A4SLC6A3ADORA3ESR1 | |
| SCHEMBL10031189 | 0.79 | SLC6A2 (0.49) | SLC6A2SLC6A4SLC6A3ADORA3ESR1 | |
| SCHEMBL27270849 | 0.78 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3ESR1ESR2 | |
| SCHEMBL27271164 | 0.78 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3ESR1ESR2 | |
| SCHEMBL27270395 | 0.78 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3016959-B1 | POLYCYCLIC COMPOUNDS | MERCK PATENT GMBH (DE) | 2017-12-27 | — | — | EP | disclosed |