Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | APLNR | P35414 | 1/20 | 0.32 |
| ▸ | PRKCA | P17252 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL29831595 | 0.85 | NOS1 (0.37) | NOS1NOS3NOS2APLNRTDP1 | |
| SCHEMBL3034322 | 0.84 | NOS1 (0.36) | NOS1NOS3NOS2APLNRLMNA | |
| SCHEMBL3614758 | 0.84 | NOS1 (0.36) | NOS1NOS3NOS2APLNRLMNA | |
| SCHEMBL5426250 | 0.84 | NOS1 (0.36) | NOS1NOS3NOS2APLNRLMNA | |
| SCHEMBL7387563 | 0.84 | NOS1 (0.36) | NOS1NOS3NOS2APLNRLMNA | |
| SCHEMBL27465052 | 0.84 | NOS1 (0.36) | NOS1NOS3NOS2APLNRLMNA | |
| SCHEMBL7353444 | 0.81 | TDP1 (0.37) | NOS1NOS3NOS2TDP1LMNA | |
| SCHEMBL27593351 | 0.81 | NOS1 (0.34) | NOS1NOS3NOS2APLNR | |
| SCHEMBL27593350 | 0.81 | NOS1 (0.34) | NOS1NOS3NOS2APLNR | |
| SCHEMBL27391716 | 0.81 | NOS1 (0.37) | NOS1NOS3NOS2TDP1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106467612-A | Sugared cluster compound and its pharmaceutically acceptable salt, their purposes and a kind of pharmaceutical composition | 北京大学 | 2017-03-01 | — | — | CN | claimed |
| CN-106467612-B | Sugared cluster compound and its pharmaceutically acceptable salt, their purposes and a kind of pharmaceutical composition | 北京大学 | 2019-08-20 | — | — | CN | disclosed |
| CN-106467612-A | Sugared cluster compound and its pharmaceutically acceptable salt, their purposes and a kind of pharmaceutical composition | 北京大学 | 2017-03-01 | — | — | CN | disclosed |