Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 2/20 | 0.32 |
| ▸ | BCHE | P06276 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 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 | |
|---|---|---|---|---|
| SCHEMBL5549322 | 0.79 | ADORA1 (0.45) | ADORA1RAB9A | |
| SCHEMBL5549074 | 0.79 | ADORA1 (0.49) | ADORA1CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL5549397 | 0.77 | ADORA1 (0.43) | ADORA1HPGD | |
| SCHEMBL5548564 | 0.76 | ADORA1 (0.42) | ADORA1MEN1KMT2ACYP3A4CYP2C9 | |
| SCHEMBL5543503 | 0.71 | ADORA1 (0.50) | ADORA1CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL3527144 | 0.65 | RAB9A (0.44) | ADORA1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL5543633 | 0.64 | ADORA1 (0.50) | ADORA1CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL5356781 | 0.61 | ADORA1 (0.45) | ADORA1 | |
| SCHEMBL5355821 | 0.60 | ADORA1 (0.46) | ADORA1KMT2ACDK1 | |
| SCHEMBL14839517 | 0.55 | RIPK1 (0.50) | USP2RAB9AMEN1KMT2ACYP2C19 |
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-1678180-B1 | SUBSTITUTED 2H-[1,2,4]TRIAZOLO 4,3-A PYRAZINES AS GSK-3 INHIBITORS | PFIZER PROD INC (US) | 2007-08-08 | — | — | EP | disclosed |