Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 2/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.38 |
| ▸ | KIT | P10721 | 3/20 | 0.38 |
| ▸ | FLT3 | P36888 | 3/20 | 0.38 |
| ▸ | KDR | P35968 | 3/20 | 0.38 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | INSR | P06213 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
| ▸ | LYN | P07948 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29967996 | 0.92 | ABL1 (0.38) | KITFLT3KDRPLK4AURKA | |
| SCHEMBL29968331 | 0.90 | KDM4C (0.38) | AGTR2ACMSDKITFLT3KDR | |
| SCHEMBL29968259 | 0.90 | AGTR2 (0.37) | AGTR2ACMSDKDRMAPK8ABL1 | |
| SCHEMBL31029250 | 0.90 | DHODH (0.39) | AGTR2ACMSDFLT3KDRPLK4 | |
| SCHEMBL29968332 | 0.90 | ACMSD (0.38) | AGTR2ACMSDKITFLT3KDR | |
| SCHEMBL29967523 | 0.89 | MAPK8 (0.41) | AGTR2ACMSDMAPK8ABL1BCR | |
| SCHEMBL29968241 | 0.87 | ACMSD (0.36) | AGTR2ACMSDKITFLT3KDR | |
| SCHEMBL29968299 | 0.86 | KIT (0.43) | KITFLT3KDRPLK4AURKA | |
| SCHEMBL29967707 | 0.86 | MAPK10 (0.43) | AGTR2KITFLT3KDRPLK4 | |
| SCHEMBL29967591 | 0.85 | MAPK8 (0.41) | KITFLT3KDRPLK4AURKA |
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 2 patents. 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 |
| CN-115260165-A | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-11-01 | — | — | CN | disclosed |