Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 5/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.40 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.35 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | GALR2 | O43603 | 1/20 | 0.34 |
| ▸ | GALR1 | P47211 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28544155 | 0.94 | TLR9 (0.35) | TLR9TLR7CXCR2TP53 | |
| SCHEMBL28530744 | 0.94 | TLR9 (0.35) | TLR9TLR7CXCR2TP53 | |
| SCHEMBL22724634 | 0.89 | KRAS (0.39) | TLR9TLR7CXCR2 | |
| SCHEMBL22720267 | 0.85 | HTR2C (0.31) | TLR9TLR7 | |
| SCHEMBL22720279 | 0.77 | TLR9 (0.43) | TLR9TLR7GPR119ACHE | |
| SCHEMBL28537273 | 0.70 | TLR9 (0.35) | TLR9TLR7 | |
| SCHEMBL31651847 | 0.68 | ALDH1A1 (0.45) | ABCB1ALKGPR119TP53 | |
| SCHEMBL23119215 | 0.67 | GRM5 (0.45) | ABCB1GPR119TGFBR1 | |
| SCHEMBL12454614 | 0.65 | RIPK1 (0.46) | — | |
| SCHEMBL22720268 | 0.65 | KRAS (0.39) | TLR9GPR119 |
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-2020239123-A1 | AROMATIC HETEROCYCLIC DERIVATIVE MODULATOR AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2020-12-03 | — | — | WO | disclosed |