Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | UTS2R | Q9UKP6 | 8/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 4/20 | 0.46 |
| ▸ | CCR1 | P32246 | 2/20 | 0.46 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28975793 | 0.92 | PIN1 (0.48) | HTTUTS2RMEN1RAB9AKMT2A | |
| SCHEMBL28975814 | 0.92 | PIN1 (0.50) | MEN1NPC1RAB9AKMT2APIN1 | |
| SCHEMBL28975797 | 0.89 | PIN1 (0.43) | HTTMEN1NPC1RAB9AKMT2A | |
| SCHEMBL28975803 | 0.88 | TAS1R3 (0.51) | UTS2RMEN1NPC1RAB9AKMT2A | |
| SCHEMBL28975818 | 0.88 | PIN1 (0.53) | HTTUTS2RNPC1RAB9APIN1 | |
| SCHEMBL28975791 | 0.85 | SMN1; SMN2 (0.42) | MEN1NPC1RAB9AKMT2APIN1 | |
| SCHEMBL28975815 | 0.83 | NPC1 (0.43) | MEN1NPC1RAB9AKMT2APIN1 | |
| SCHEMBL28975822 | 0.83 | TAS1R3 (0.47) | NPC1RAB9APIN1 | |
| SCHEMBL28975774 | 0.82 | HTT (0.49) | HTTMEN1NPC1RAB9AKMT2A | |
| SCHEMBL28975805 | 0.82 | HDAC3 (0.39) | MEN1NPC1RAB9AKMT2APIN1 |
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-115850111-A | Preparation method of nickel-catalyzed aliphatic amine containing gem-difluoroolefin structure | 天津师范大学 | 2023-03-28 | — | — | CN | disclosed |