Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 6/20 | 0.50 |
| ▸ | FLT3 | P36888 | 5/20 | 0.50 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | KIT | P10721 | 1/20 | 0.34 |
| ▸ | FLT1 | P17948 | 1/20 | 0.34 |
| ▸ | FLT4 | P35916 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.33 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.32 |
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 1/20 | 0.30 |
| ▸ | AKT2 | P31751 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29967702 | 0.79 | KDR (0.56) | KDRFLT3SCN5ASCN9ALCK | |
| SCHEMBL28871292 | 0.79 | KDR (0.56) | KDRFLT3SCN5ASCN9ALCK | |
| SCHEMBL29967987 | 0.78 | MEN1 (0.37) | KDRFLT3PTGS2LCKCSF1R | |
| SCHEMBL29967634 | 0.75 | KDR (0.38) | KDRFLT3ACMSD | |
| SCHEMBL29967871 | 0.75 | BTK (0.38) | KDRFLT3PTGS2LCKCSF1R | |
| SCHEMBL29968082 | 0.69 | KDR (0.63) | KDRFLT3LCKCSF1RKIT | |
| SCHEMBL28871294 | 0.69 | KDR (0.45) | KDRFLT3SCN5ASCN9AMAPK1 | |
| SCHEMBL29968393 | 0.69 | KDR (0.45) | KDRFLT3SCN5ASCN9AMAPK1 | |
| SCHEMBL12374175 | 0.68 | KCNH2 (0.36) | PTGS2HDAC1HDAC2HDAC3ACMSD | |
| SCHEMBL419499 | 0.67 | KDR (0.56) | KDRFLT3SCN5ASCN9ALCK |
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 |