Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MERTK | Q12866 | 6/20 | 0.63 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.53 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | GSK3A | P49840 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.49 |
| ▸ | CCR4 | P51679 | 1/20 | 0.49 |
| ▸ | CDK1 | P06493 | 1/20 | 0.47 |
| ▸ | CDK4 | P11802 | 1/20 | 0.47 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.47 |
| ▸ | CCND1 | P24385 | 1/20 | 0.47 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8901180 | 0.99 | MERTK (0.62) | MERTKADORA3ADORA2AADORA1NPY5R | |
| SCHEMBL8901670 | 0.91 | NPY5R (0.65) | MERTKADORA3ADORA2AADORA1NPY5R | |
| Hydrochloric Acid SCHEMBL8892514 | 0.90 | NPY5R (0.64) | MERTKADORA3ADORA2AADORA1NPY5R | |
| SCHEMBL8891296 | 0.86 | MERTK (0.52) | MERTKMEN1KMT2AHSP90AA1GSK3A | |
| SCHEMBL8892661 | 0.85 | MERTK (0.56) | MERTKADORA3ADORA2AADORA1MEN1 | |
| Hydrochloric Acid SCHEMBL8890483 | 0.84 | MERTK (0.56) | MERTKADORA3ADORA2AADORA1MEN1 | |
| SCHEMBL8891493 | 0.83 | ULK1 (0.50) | MERTKCCR4HSD17B10 | |
| SCHEMBL27224044 | 0.80 | MERTK (0.81) | MERTKADORA3ADORA2AADORA1NPY5R | |
| SCHEMBL8891017 | 0.79 | NPY5R (0.53) | MERTKNPY5RUSP2CYP1A2CYP3A4 | |
| SCHEMBL27223324 | 0.78 | MERTK (0.73) | MERTKNPY5RMEN1KMT2AHSP90AA1 |
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-1997020822-A1 | QUINAZOLIN-2,4-DIAZIRINES AS NPY RECEPTOR ANTAGONIST | NOVARTIS AG (CH) | 1997-06-12 | — | — | WO | claimed |