Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 6/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 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 | |
|---|---|---|---|---|
| SCHEMBL31047547 | 0.85 | HRH3 (0.38) | ALKHRH3TGFBR1ACVR1KCNH2 | |
| SCHEMBL30899876 | 0.83 | HRH3 (0.42) | ALKHRH3TGFBR1ACVR1KCNH2 | |
| SCHEMBL31047532 | 0.81 | ALK (0.36) | ALKHRH3TGFBR1ACVR1KCNH2 | |
| SCHEMBL30899902 | 0.81 | TLR9 (0.47) | TGFBR1ACVR1KCNH2MAPTTLR9 | |
| SCHEMBL30899883 | 0.80 | PTGS2 (0.43) | HRH3 | |
| SCHEMBL30899930 | 0.80 | HRH3 (0.41) | ALKHRH3TGFBR1ACVR1KCNH2 | |
| SCHEMBL31047548 | 0.79 | HRH3 (0.36) | ALKHRH3TGFBR1ACVR1KCNH2 | |
| SCHEMBL31047538 | 0.79 | ALDH1A1 (0.39) | ALKHRH3TGFBR1ACVR1KCNH2 | |
| SCHEMBL31047587 | 0.78 | HRH3 (0.40) | ALKHRH3TGFBR1ACVR1KCNH2 | |
| SCHEMBL31047539 | 0.77 | HRH3 (0.39) | ALKHRH3TGFBR1ACVR1KCNH2 |
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-2024163380-A1 | SUBSTITUTED BENZIMIDAZOLE COMPOUNDS USEFUL AS INHIBITORS OF TLR9 | BRISTOL-MYERS SQUIBB COMPANY (US) | 2024-08-08 | — | — | WO | disclosed |