Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 14/20 | 0.34 |
| ▸ | FLT3 | P36888 | 9/20 | 0.34 |
| ▸ | KIT | P10721 | 9/20 | 0.34 |
| ▸ | ABL1 | P00519 | 6/20 | 0.33 |
| ▸ | CSF1R | P07333 | 5/20 | 0.33 |
| ▸ | PRKACA | P17612 | 4/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.33 |
| ▸ | LCK | P06239 | 4/20 | 0.33 |
| ▸ | FLT1 | P17948 | 4/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.33 |
| ▸ | PLK4 | O00444 | 3/20 | 0.33 |
| ▸ | AURKA | O14965 | 3/20 | 0.33 |
| ▸ | JAK2 | O60674 | 3/20 | 0.33 |
| ▸ | CDK1 | P06493 | 3/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.33 |
| ▸ | CDK2 | P24941 | 3/20 | 0.33 |
| ▸ | MARK3 | P27448 | 3/20 | 0.33 |
| ▸ | MARK2 | Q7KZI7 | 3/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29968088 | 0.82 | KIT (0.41) | PTGS2KDRFLT3KITABL1 | |
| SCHEMBL29967841 | 0.82 | KDR (0.40) | PTGS2KDRFLT3KITABL1 | |
| SCHEMBL29967591 | 0.81 | MAPK8 (0.41) | PTGS2KDRFLT3KITABL1 | |
| SCHEMBL29968007 | 0.79 | ABL1 (0.38) | PTGS2KDRFLT3KITABL1 | |
| SCHEMBL29967707 | 0.78 | MAPK10 (0.43) | KDRFLT3KITABL1CSF1R | |
| SCHEMBL29967787 | 0.78 | KDR (0.34) | KDRFLT3KITABL1CSF1R | |
| SCHEMBL29967950 | 0.78 | PTGS2 (0.39) | PTGS2KDRFLT3KITCSF1R | |
| SCHEMBL29967788 | 0.77 | KDR (0.41) | KDRFLT3KITABL1CSF1R | |
| SCHEMBL29967914 | 0.76 | AGTR2 (0.40) | PTGS2KDRFLT3KITABL1 | |
| SCHEMBL29967799 | 0.74 | KDR (0.41) | PTGS2KDRFLT3KITABL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115260165-B | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2024-08-06 | — | — | CN | disclosed |