Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.45 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 2/20 | 0.40 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.40 |
| ▸ | FPR3 | P25089 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.39 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL28545803 | 1.00 | USP30 (0.45) | USP30ANO1HDAC4HDAC6CNR1 | |
| SCHEMBL29412026 | 1.00 | USP30 (0.45) | USP30ANO1HDAC4HDAC6CNR1 | |
| SCHEMBL21777060 | 0.94 | USP30 (0.44) | USP30HDAC4HDAC6PARP1BTK | |
| SCHEMBL29412004 | 0.94 | USP30 (0.44) | USP30HDAC4HDAC6PARP1BTK | |
| SCHEMBL21777561 | 0.91 | USP30 (0.48) | USP30ANO1HDAC4HDAC6CNR1 | |
| SCHEMBL21777558 | 0.91 | USP30 (0.48) | USP30ANO1HDAC4HDAC6CNR1 | |
| SCHEMBL1748149 | 0.88 | ALDH1A1 (0.51) | CNR1EHMT2GPR119ALDH1A1 | |
| SCHEMBL29261760 | 0.86 | BTK (0.52) | USP30ANO1HDAC4HDAC6CNR1 | |
| SCHEMBL935824 | 0.82 | USP30 (0.46) | USP30ANO1HDAC4HDAC6CNR1 | |
| SCHEMBL14672575 | 0.81 | ANO1 (0.47) | USP30ANO1HDAC4HDAC6CNR1 |
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-112638910-B | New heterocyclic amine derivatives and pharmaceutical compositions containing the same | 株式会社大熊制药 | 2024-06-11 | — | — | CN | disclosed |
| CN-112638910-A | Novel heterocyclic amine derivatives and pharmaceutical compositions comprising the same | 株式会社大熊制药 | 2021-04-09 | — | — | CN | disclosed |