Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.31 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.31 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL16072799 | 0.73 | HTR2A (0.34) | HTR2BHTR2AHTR2CPARP2HRH3 | |
| SCHEMBL22724669 | 0.72 | HRH3 (0.38) | PARP2HRH3 | |
| SCHEMBL30169468 | 0.72 | HTR2C (0.70) | HTR2BHTR2AHTR2CHRH3ACHE | |
| SCHEMBL12309469 | 0.71 | KDM5A (0.42) | HTR2BHTR2AHTR2CNOS1 | |
| SCHEMBL22733199 | 0.71 | CHRM2 (0.33) | PARP2NOS1NOS2CHRM2CHRM3 | |
| SCHEMBL22724570 | 0.71 | HTR2C (0.35) | HTR2BHTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL22720410 | 0.70 | TP53 (0.40) | HTR2BHTR2AHTR2CNOS1NOS2 | |
| SCHEMBL4399691 | 0.68 | PIK3CD (0.37) | HTR2BHTR2AHTR2CCHRM2CHRM3 | |
| SCHEMBL30333755 | 0.68 | — | — | |
| SCHEMBL22720469 | 0.67 | TP53 (0.53) | — |
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-2020239123-A1 | AROMATIC HETEROCYCLIC DERIVATIVE MODULATOR AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2020-12-03 | — | — | WO | disclosed |