Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | CLK1 | P49759 | 1/20 | 0.34 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
| ▸ | CLK3 | P49761 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 7/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 7/20 | 0.34 |
| ▸ | ATR | Q13535 | 6/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.34 |
| ▸ | ATRIP | Q8WXE1 | 4/20 | 0.34 |
| ▸ | MTOR | P42345 | 2/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1225735 | 1.00 | MCHR1 (0.36) | MCHR1CCNT1CDK9DYRK1ACLK1 | |
| SCHEMBL1224598 | 0.87 | CCNT1 (0.37) | MCHR1CCNT1CDK9DYRK1ACLK1 | |
| SCHEMBL1462584 | 0.73 | TSHR (0.39) | MCHR1DYRK1APIK3CDPIK3CAADORA2B | |
| SCHEMBL1565269 | 0.72 | PDE8B (0.34) | MCHR1CCNT1CDK9DYRK1ACLK1 | |
| SCHEMBL22023318 | 0.69 | CCNT1 (0.45) | CCNT1CDK9DYRK1ACLK1CLK2 | |
| SCHEMBL30629336 | 0.66 | MCHR1 (0.46) | MCHR1ADORA2BGRM4IRAK4 | |
| SCHEMBL1225737 | 0.66 | CCNT1 (0.37) | MCHR1CCNT1 | |
| SCHEMBL1225970 | 0.66 | CCNT1 (0.37) | MCHR1CCNT1 | |
| SCHEMBL18983775 | 0.65 | IKBKE (0.46) | — | |
| SCHEMBL1192038 | 0.63 | MPO (0.47) | MTORADORA2B |
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-2459535-A1 | PYRIDINE AND PYRAZINE DERIVATIVES AS PROTEIN KINASE MODULATORS | Novartis AG (CH) | 2012-06-06 | — | — | EP | disclosed |
| WO-2011012661-A1 | PYRIDINE AND PYRAZINE DERIVATIVES AS PROTEIN KINASE MODULATORS | NOVARTIS AG (CH) | 2011-02-03 | — | — | WO | disclosed |