Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | AXL | P30530 | 1/20 | 0.32 |
| ▸ | FLT3 | P36888 | 1/20 | 0.32 |
| ▸ | MERTK | Q12866 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL28387564 | 0.81 | AXL (0.45) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL12618998 | 0.79 | PDE4A (0.47) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL24087299 | 0.79 | PDE4A (0.41) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL338573 | 0.76 | PDE4A (0.41) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL21646478 | 0.76 | PDE4A (0.41) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL19435479 | 0.75 | SLC22A12 (0.46) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL25124615 | 0.72 | PDE4A (0.39) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL23432493 | 0.72 | KEAP1 (0.39) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL10630256 | 0.69 | PDE4A (0.50) | PDE4APDE3ACYP3A4HPGDNFKB1 | |
| SCHEMBL22715717 | 0.69 | MAOB (0.40) | HPGDHSD17B10DYRK1AKEAP1MEN1 |
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-3870582-B1 | 5-AZAINDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 2023-07-19 | — | — | EP | claimed |