Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.36 |
| ▸ | NFATC1 | O95644 | 2/20 | 0.36 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KDM5A | P29375 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29955564 | 0.78 | ERN1 (0.41) | ERN1ROCK2ADORA3ADORA2ADYRK1A | |
| SCHEMBL25899284 | 0.76 | ADORA3 (0.39) | ROCK2ADORA3ADORA2ADYRK1ANFATC1 | |
| SCHEMBL29856233 | 0.76 | ERN1 (0.39) | ERN1ROCK2ADORA3ADORA2ADYRK1A | |
| SCHEMBL6487514 | 0.74 | ALDH1A1 (0.68) | ERN1ROCK2DYRK1ANFATC1GSK3B | |
| SCHEMBL1609661 | 0.70 | ADORA3 (0.54) | ROCK2ADORA3ADORA2ADYRK1ANFATC1 | |
| SCHEMBL29856230 | 0.70 | ROCK2 (0.42) | ROCK2ADORA3ADORA2ALMNAHTT | |
| SCHEMBL22346601 | 0.69 | KDM4E (0.53) | ADORA3ADORA2AALDH1A1LMNAPOLB | |
| SCHEMBL25617163 | 0.68 | TOP2A (0.37) | ADORA3ADORA2ADYRK1ANFATC1GSK3B | |
| SCHEMBL29856212 | 0.66 | ADORA3 (0.40) | ROCK2ADORA3ADORA2AALDH1A1LMNA | |
| SCHEMBL14621514 | 0.66 | LMNA (0.54) | ALDH1A1LMNACYP1A2POLBCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022169974-A1 | INHIBITORS OF URAT1 AND PHARMACEUTICAL USES THEREOF | NEXYS THERAPEUTICS, INC. (US) | 2022-08-11 | — | — | WO | disclosed |