Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 4/20 | 0.39 |
| ▸ | ADCY5 | O95622 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL38651777 | 1.00 | HDAC4 (0.47) | HDAC4POLBHTR6ADCY5HRH4 | |
| SCHEMBL38651646 | 0.88 | HRH3 (0.46) | HDAC4POLBHTR6HRH4HRH3 | |
| SCHEMBL27381924 | 0.80 | FGFR1 (0.42) | HDAC4POLBHTR6HRH3TSHR | |
| SCHEMBL38651572 | 0.79 | L3MBTL3 (0.46) | HRH3 | |
| SCHEMBL38651513 | 0.79 | L3MBTL3 (0.50) | HRH3 | |
| SCHEMBL38651641 | 0.78 | PIM1 (0.38) | HTR6HRH4HRH3 | |
| SCHEMBL38651579 | 0.75 | HTR6 (0.39) | HTR6HRH4HRH3MAP4K4 | |
| SCHEMBL27380687 | 0.75 | ADRA2C (0.50) | HDAC4HRH4KMT2A | |
| SCHEMBL38651750 | 0.75 | ADRA2C (0.50) | HDAC4HRH4KMT2A | |
| SCHEMBL30773599 | 0.75 | CTSS (0.41) | HDAC4CTSS |
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-2024062250-A1 | IMIDAZOLYL-AMINO-PYRAZINE-CARBONITRILS AS CHK-1 INHIBITORS | BENEVOLENTAI BIO LIMITED (GB) | 2024-03-28 | — | — | WO | disclosed |