Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | MGMT | P16455 | 2/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | TPO | P07202 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | EPX | P11678 | 1/20 | 0.34 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL31521283 | 0.83 | PIN1 (0.37) | PIN1L3MBTL1MAPK14PTGESPDE5A | |
| SCHEMBL31521293 | 0.83 | PIN1 (0.37) | PIN1L3MBTL1MAPK14PTGESPDE5A | |
| SCHEMBL25165363 | 0.80 | PIN1 (0.40) | PIN1L3MBTL1MAPK14PTGESPDE5A | |
| SCHEMBL25164958 | 0.80 | PTGES (0.40) | PIN1L3MBTL1MAPK14PTGESPDE5A | |
| SCHEMBL25336522 | 0.78 | PIN1 (0.39) | PIN1L3MBTL1MAPK14PTGESPDE5A | |
| SCHEMBL31041031 | 0.77 | PIN1 (0.41) | PIN1L3MBTL1MAPK14PTGESPDE5A | |
| SCHEMBL27209714 | 0.76 | PIN1 (0.37) | PIN1L3MBTL1MAPK14PTGESPDE5A | |
| SCHEMBL23043480 | 0.73 | PIN1 (0.45) | PIN1L3MBTL1PTGESPDE5AMGMT | |
| SCHEMBL30989561 | 0.72 | SMN1; SMN2 (0.38) | MAPK14MPOHTTMAOB | |
| SCHEMBL31492957 | 0.72 | L3MBTL1 (0.53) | PIN1L3MBTL1PDE5ADAPK1CNR1 |
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-116332948-A | Nitrogen-containing tetracyclic compound, preparation method and medicinal application thereof | 翰森生物有限责任公司 | 2023-06-27 | — | — | CN | disclosed |