Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 2/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 2/20 | 0.42 |
| ▸ | MMP3 | P08254 | 2/20 | 0.42 |
| ▸ | MMP8 | P22894 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25976092 | 0.86 | NPC1 (0.42) | FAAHHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL25976421 | 0.83 | PSMB5 (0.49) | CHRNB2CHRNB4CHRNA3CHRNA4FAAH | |
| SCHEMBL17128773 | 0.83 | CHRNB2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA4FAAH | |
| SCHEMBL16485202 | 0.83 | CHRNB2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA4FAAH | |
| SCHEMBL17178170 | 0.83 | CHRNB2 (0.52) | CHRNB2CHRNB4CHRNA3CHRNA4FAAH | |
| SCHEMBL25497019 | 0.82 | FAAH (0.60) | CHRNB2CHRNB4CHRNA3CHRNA4FAAH | |
| SCHEMBL17177757 | 0.81 | CHRNB2 (0.55) | CHRNB2CHRNB4CHRNA3CHRNA4CHRNA1 | |
| SCHEMBL27377994 | 0.79 | PSMB5 (0.51) | FAAHHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL25887442 | 0.78 | HDAC3 (0.53) | CHRNB2CHRNB4CHRNA3CHRNA4FAAH | |
| SCHEMBL25975485 | 0.78 | AKT1 (0.50) | CHRNB2CHRNB4CHRNA3CHRNA4FAAH |
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 |
|---|---|---|---|---|---|---|---|
| EP-4223318-A1 | ANTITUMOR COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | Duality Biologics (Suzhou) Co., Ltd. (CN) | 2023-08-09 | — | — | EP | disclosed |