Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 1/20 | 0.50 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30354850 | 0.84 | GAA (0.53) | NOS3NOS1PIM1DYRK1AFLT1 | |
| SCHEMBL2194043 | 0.82 | SYK (0.46) | NOS3NOS1PIM1DYRK1AFLT1 | |
| Hydrochloric Acid SCHEMBL2195908 | 0.81 | SYK (0.45) | NOS3NOS1FLT1EPHA2KDR | |
| SCHEMBL4034116 | 0.79 | NOS3 (0.40) | NOS3NOS1PIM1DYRK1AFLT1 | |
| SCHEMBL29151258 | 0.77 | TDP1 (0.43) | NOS3NOS1MAPTALDH1A1MEN1 | |
| SCHEMBL25383253 | 0.75 | SYK (0.38) | MAPTMAPK1SYKL3MBTL1ALDH1A1 | |
| SCHEMBL30354875 | 0.75 | SYK (0.38) | MAPTSYKL3MBTL1ALDH1A1MEN1 | |
| SCHEMBL6068555 | 0.75 | SYK (0.48) | NOS3NOS1KDRMAPTSYK | |
| SCHEMBL25384673 | 0.75 | SYK (0.38) | MAPTSYKL3MBTL1ALDH1A1MEN1 | |
| SCHEMBL1406446 | 0.75 | SYK (0.65) | NOS3NOS1SYKL3MBTL1EGFR |
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-115955968-A | Carbohydrazone acyldinitrile compounds comprising at least two aryl or heteroaryl groups connected by a novel linker and uses thereof | 韩国科学技术研究院 | 2023-04-11 | — | — | CN | disclosed |