Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.43 |
| ▸ | HTR2A | P28223 | 6/20 | 0.43 |
| ▸ | DRD2 | P14416 | 5/20 | 0.43 |
| ▸ | HTR2C | P28335 | 4/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5320036 | 0.81 | SIGMAR1 (0.46) | SIGMAR1HRH3HTR2ADRD2HTR2C | |
| SCHEMBL25823989 | 0.78 | HRH3 (0.40) | HRH3HTR2ADRD2CYP2C9EPHX2 | |
| SCHEMBL5313073 | 0.77 | SIGMAR1 (0.54) | SIGMAR1HRH3HTR2ADRD2HTR2C | |
| SCHEMBL5319956 | 0.77 | HTR2A (0.51) | SIGMAR1HRH3HTR2ADRD2HTR2C | |
| SCHEMBL5322616 | 0.77 | RXRA (0.51) | SIGMAR1HTR2ADRD2HTR2CKCNH2 | |
| SCHEMBL23277757 | 0.76 | CCR1 (0.41) | HRH3KCNH2 | |
| SCHEMBL14435512 | 0.76 | HTR2A (0.48) | SIGMAR1HRH3HTR2ADRD2HTR2C | |
| SCHEMBL14494676 | 0.75 | SIGMAR1 (0.52) | SIGMAR1HRH3HTR2ADRD2HTR2C | |
| SCHEMBL5319145 | 0.75 | GPR119 (0.42) | SIGMAR1HRH3HTR2ADRD2HTR2C | |
| SCHEMBL12391503 | 0.74 | MAPT (0.45) | HRH3KCNH2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125944-A1 | COMPOUND CONTAINING HETEROCYCLIC RING | 正大天晴药业集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |