Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | FAAH | O00519 | 2/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25967838 | 1.00 | AKT1 (0.50) | AKT1FAAHHDAC3HDAC4HDAC1 | |
| SCHEMBL24835050 | 0.97 | AKT1 (0.49) | AKT1FAAHHDAC3HDAC4HDAC1 | |
| SCHEMBL25979696 | 0.92 | AKT1 (0.50) | AKT1FAAHHDAC3HDAC4HDAC1 | |
| SCHEMBL24320754 | 0.92 | AKT1 (0.48) | AKT1FAAHHDAC3HDAC4HDAC1 | |
| SCHEMBL22519634 | 0.91 | AKT1 (0.49) | AKT1FAAHHDAC3HDAC4HDAC1 | |
| SCHEMBL25967517 | 0.91 | AKT1 (0.49) | AKT1FAAHHDAC3HDAC4HDAC1 | |
| SCHEMBL23630030 | 0.91 | AKT1 (0.48) | AKT1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL23630027 | 0.91 | AKT1 (0.48) | AKT1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL25873361 | 0.91 | AKT1 (0.48) | AKT1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL20787950 | 0.91 | FAAH (0.50) | AKT1FAAHHDAC3HDAC4HDAC1 |
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 |