Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 6/20 | 0.43 |
| ▸ | DYRK1B | Q9Y463 | 5/20 | 0.43 |
| ▸ | DYRK2 | Q92630 | 3/20 | 0.43 |
| ▸ | PRKCI | P41743 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | CLK1 | P49759 | 3/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | CLK3 | P49761 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19594729 | 0.87 | CHRM2 (0.42) | ERN1DYRK1ADYRK1BDYRK2PRKCI | |
| SCHEMBL8895190 | 0.81 | LMNA (0.47) | DYRK1ADYRK1BDYRK2SLC6A2SLC6A4 | |
| SCHEMBL9587145 | 0.75 | ALDH1A1 (0.50) | SLC6A4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL13458449 | 0.75 | PRKCI (0.45) | ERN1DYRK1ADYRK1BDYRK2PRKCI | |
| SCHEMBL1465591 | 0.73 | SLC6A2 (0.44) | ERN1PRKCISLC6A2SLC6A4HDAC3 | |
| SCHEMBL13365167 | 0.72 | SLC6A2 (0.46) | ERN1PRKCISLC6A2SLC6A4HDAC3 | |
| SCHEMBL21907080 | 0.71 | PRKCI (0.45) | ERN1DYRK1ADYRK1BDYRK2PRKCI | |
| SCHEMBL12742727 | 0.71 | DYRK1A (0.44) | ERN1DYRK1ADYRK1BDYRK2PRKCI | |
| SCHEMBL339129 | 0.70 | DYRK1A (0.61) | ERN1DYRK1ADYRK1BDYRK2PRKCI | |
| SCHEMBL12825139 | 0.69 | PIK3CA (0.42) | PIK3CANPC1RAB9A |
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-2674428-B1 | Modulators of ATP-binding cassette transporters | VERTEX PHARMA (US) | 2016-04-06 | — | — | EP | disclosed |