Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.37 |
| ▸ | KIT | P10721 | 3/20 | 0.36 |
| ▸ | KDR | P35968 | 3/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.33 |
| ▸ | FLT3 | P36888 | 2/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | INSR | P06213 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | LYN | P07948 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 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 | |
|---|---|---|---|---|
| SCHEMBL29967996 | 0.84 | ABL1 (0.38) | PTGS2KITKDRMAPK8FLT3 | |
| SCHEMBL29967914 | 0.83 | AGTR2 (0.40) | PTGS2KITKDRMAPK8FLT3 | |
| SCHEMBL29967591 | 0.83 | MAPK8 (0.41) | PTGS2KITKDRMAPK8FLT3 | |
| SCHEMBL29968100 | 0.82 | MAP2K1 (0.34) | PTGS2KITKDRMAPK8FLT3 | |
| SCHEMBL29967707 | 0.78 | MAPK10 (0.43) | KITKDRMAPK8FLT3PLK4 | |
| SCHEMBL31029249 | 0.78 | PTGS2 (0.35) | PTGS2KITKDRMAPK8FLT3 | |
| SCHEMBL29968331 | 0.77 | KDM4C (0.38) | KITKDRMAPK8FLT3PLK4 | |
| SCHEMBL29967841 | 0.77 | KDR (0.40) | PTGS2KITKDRFLT3PLK4 | |
| SCHEMBL29967968 | 0.76 | MAPK10 (0.44) | KITKDRMAPK8FLT3PLK4 | |
| SCHEMBL29967816 | 0.75 | PRMT6 (0.39) | MAPK8CSF1RFGFR1FLT4 |
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 |