Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.31 |
| ▸ | SETD7 | Q8WTS6 | 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 | |
|---|---|---|---|---|
| SCHEMBL16697373 | 0.88 | MAP4K4 (0.35) | MAP4K4HDAC1ALDH1A1GPR119SETD7 | |
| SCHEMBL16711379 | 0.87 | MAP4K4 (0.36) | MAP4K4HDAC1GPR119SETD7 | |
| SCHEMBL16711114 | 0.84 | ADORA1 (0.37) | MAP4K4HDAC1ALDH1A1GPR119 | |
| SCHEMBL16728645 | 0.79 | NR1H2 (0.36) | ALDH1A1GPR119 | |
| SCHEMBL30622818 | 0.78 | SETD7 (0.34) | MAP4K4HDAC1GPR119SETD7 | |
| SCHEMBL26645349 | 0.78 | SETD7 (0.34) | MAP4K4HDAC1GPR119SETD7 | |
| SCHEMBL30622784 | 0.78 | SETD7 (0.34) | MAP4K4HDAC1GPR119SETD7 | |
| SCHEMBL19784974 | 0.77 | MAP4K4 (0.34) | MAP4K4HDAC1ALDH1A1GPR119SETD7 | |
| SCHEMBL16700414 | 0.74 | NR1H2 (0.33) | ALDH1A1GPR119 | |
| SCHEMBL16701000 | 0.74 | ADORA1 (0.31) | — |
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-2015073767-A1 | SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2015-05-21 | — | — | WO | disclosed |