Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL29167869 | 0.81 | NOS1 (0.32) | NOS1NOS3NOS2 | |
| SCHEMBL17756070 | 0.79 | PRKCA (0.32) | NOS1NOS3NOS2 | |
| SCHEMBL30207652 | 0.77 | LMNA (0.30) | — | |
| SCHEMBL17756071 | 0.76 | DGAT1 (0.32) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL2581321 | 0.75 | AAK1 (0.38) | MAOAMAOB | |
| SCHEMBL18644426 | 0.75 | CPB2 (0.35) | CHRNB2CHRNB4CHRNA3CHRNA4NOS1 | |
| SCHEMBL594264 | 0.75 | NOS1 (0.40) | NOS1NOS3NOS2MAOAMAOB | |
| SCHEMBL1841165 | 0.75 | NOS1 (0.40) | NOS1NOS3NOS2MAOAMAOB | |
| SCHEMBL7380045 | 0.75 | NOS1 (0.36) | NOS1NOS3NOS2MAOAMAOB | |
| SCHEMBL21301754 | 0.74 | NOS1 (0.31) | CHRNB2CHRNB4CHRNA3CHRNA4NOS1 |
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-113853383-A | Immunomodulator | 百时美施贵宝公司 | 2021-12-28 | — | — | CN | disclosed |