Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16741919 | 0.74 | CHRM3 (0.30) | — | |
| SCHEMBL11518996 | 0.74 | — | — | |
| SCHEMBL3715845 | 0.73 | SMARCA2 (0.30) | — | |
| SCHEMBL8023877 | 0.73 | — | — | |
| Iodide SCHEMBL7846998 | 0.68 | — | — | |
| SCHEMBL611093 | 0.65 | — | — | |
| SCHEMBL9687572 | 0.61 | — | — | |
| SCHEMBL10897358 | 0.59 | — | — | |
| SCHEMBL1721038 | 0.59 | — | — | |
| SCHEMBL7383347 | 0.58 | DRD2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110770236-B | VMAT2 inhibitor compounds and compositions thereof | 纽罗克里生物科学有限公司 | 2023-03-24 | — | — | CN | disclosed |