Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 9/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | LIPE | Q05469 | 3/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28744834 | 0.86 | POLB (0.45) | POLBCASP6PIN1RAB9ALIPE | |
| SCHEMBL28745142 | 0.83 | POLB (0.43) | POLBCASP6PIN1RAB9ALIPE | |
| SCHEMBL28744846 | 0.80 | KIF11 (0.43) | POLBCASP6PIN1LIPESMN1; SMN2 | |
| SCHEMBL29041274 | 0.77 | PIN1 (0.60) | POLBCASP6PIN1RAB9ACYP1A2 | |
| SCHEMBL28744879 | 0.74 | PLAAT3 (0.45) | RAB9ALIPEF2F10SMN1; SMN2 | |
| SCHEMBL12813335 | 0.70 | AXL (0.52) | POLBCASP6PIN1SMN1; SMN2 | |
| SCHEMBL9945481 | 0.70 | PIN1 (0.47) | POLBPIN1F10 | |
| SCHEMBL28724684 | 0.69 | MEN1 (0.43) | RAB9ACYP1A2SMN1; SMN2KIF11 | |
| SCHEMBL29255026 | 0.69 | LTA4H (0.53) | LIPEBCHESMN1; SMN2 | |
| SCHEMBL16670419 | 0.69 | PIN1 (0.52) | POLBCASP6PIN1RAB9ACYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114276331-B | 4-aminopiperidine compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2023-05-23 | — | — | CN | disclosed |
| CN-114276331-A | 4-aminopiperidine compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2022-04-05 | — | — | CN | disclosed |