Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 | P49768 | 8/20 | 0.49 |
| ▸ | PSEN2 | P49810 | 8/20 | 0.49 |
| ▸ | APH1B | Q8WW43 | 8/20 | 0.49 |
| ▸ | NCSTN | Q92542 | 8/20 | 0.49 |
| ▸ | APH1A | Q96BI3 | 8/20 | 0.49 |
| ▸ | PSENEN | Q9NZ42 | 8/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.42 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4979190 | 0.93 | PSEN1 (0.48) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL18742469 | 0.85 | HDAC4 (0.46) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL30501854 | 0.80 | HDAC4 (0.62) | HDAC4AKR1C1ELOVL1 | |
| SCHEMBL5637311 | 0.80 | HDAC4 (0.62) | HDAC4AKR1C1ELOVL1 | |
| SCHEMBL1345655 | 0.80 | HDAC4 (0.48) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL17222252 | 0.80 | PSEN1 (0.42) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL17222255 | 0.80 | PSEN1 (0.42) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL2793934 | 0.79 | APP (0.48) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL15776222 | 0.77 | HDAC4 (0.43) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL14263409 | 0.77 | CES2 (0.46) | PSEN1PSEN2APH1BNCSTNAPH1A |
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-106957285-B | Amino New cyclobutane derivative, preparation method and its purposes as drug | 皮埃尔法布雷医药公司 | 2019-05-03 | — | — | CN | disclosed |