Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 11/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | VCP | P55072 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20655545 | 0.79 | HTR2C (0.43) | HTR6HTR2CBRD4VCPPOLB | |
| SCHEMBL18574221 | 0.75 | HTR1B (0.47) | KDM1A | |
| SCHEMBL18561728 | 0.71 | SMN1; SMN2 (0.48) | L3MBTL1KDM1A | |
| SCHEMBL12543405 | 0.70 | HTR2C (0.46) | HTR6HTR2CPOLB | |
| SCHEMBL667918 | 0.69 | HTR1B (0.65) | KDM1A | |
| SCHEMBL30007810 | 0.69 | HTR1B (0.65) | KDM1A | |
| SCHEMBL2974587 | 0.69 | MAPT (0.56) | L3MBTL1 | |
| SCHEMBL18561727 | 0.68 | HTR1B (0.50) | L3MBTL1 | |
| SCHEMBL23352277 | 0.68 | CYP1A2 (0.44) | KDM1A | |
| SCHEMBL18561726 | 0.68 | IDO1 (0.50) | KDM1A |
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-2017114500-A1 | ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY | 恩瑞生物医药科技（上海）有限公司 | 2017-07-06 | — | — | WO | disclosed |