Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL1284339 | 0.80 | TDP1 (0.37) | TSHRHCAR2TDP1MEN1KMT2A | |
| SCHEMBL6866135 | 0.78 | ALDH1A1 (0.32) | HCAR2TDP1MEN1KMT2APKM | |
| SCHEMBL2160060 | 0.76 | HCAR2 (0.35) | TSHRHCAR2TDP1MEN1KMT2A | |
| SCHEMBL15894461 | 0.74 | RARB (0.43) | TSHRHCAR2TDP1MEN1KMT2A | |
| SCHEMBL2159923 | 0.73 | MEN1 (0.33) | TDP1MEN1KMT2APDE10A | |
| SCHEMBL7449207 | 0.73 | PDE10A (0.52) | PDE10A | |
| SCHEMBL7457865 | 0.72 | TDP1 (0.31) | TDP1MEN1KMT2A | |
| SCHEMBL630361 | 0.71 | KMT2A (0.36) | HCAR2TDP1MEN1KMT2A | |
| SCHEMBL21884143 | 0.67 | ALDH1A1 (0.34) | TSHRHCAR2TDP1MEN1KMT2A | |
| SCHEMBL15963465 | 0.67 | GRM4 (0.41) | HCAR2TDP1MEN1KMT2A |
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-2580207-A1 | NITROGEN CONTAINING HETEROARYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2013-04-17 | — | — | EP | disclosed |
| WO-2011154327-A1 | NITROGEN CONTAINING HETEROARYL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-12-15 | — | — | WO | disclosed |