Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 3/20 | 0.52 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.51 |
| ▸ | HTR3B | O95264 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.48 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL24469672 | 1.00 | HTR3A (0.52) | HTR3ACRBNHTR3BADRA2AKCNE1 | |
| SCHEMBL4074347 | 0.84 | HTR3A (0.52) | HTR3AHTR3BADRA2AKCNE1ADRA2C | |
| SCHEMBL4087446 | 0.82 | HTR3A (0.56) | HTR3AHTR3BADRA2AKCNE1ADRA2C | |
| SCHEMBL29607124 | 0.80 | HTR3A (0.48) | HTR3AHTR3BADRA2AKCNE1ADRA2C | |
| SCHEMBL4074754 | 0.79 | HTR3A (0.53) | HTR3AHTR3BADRA2AKCNE1ADRA2C | |
| SCHEMBL12714378 | 0.78 | CRBN (0.53) | CRBN | |
| SCHEMBL12714376 | 0.78 | CRBN (0.53) | CRBN | |
| SCHEMBL6575375 | 0.78 | HTR3A (0.48) | HTR3AHTR3BADRA2AKCNE1ADRA2C | |
| SCHEMBL6575344 | 0.78 | HTR3A (0.48) | HTR3AHTR3BADRA2AKCNE1ADRA2C | |
| SCHEMBL6575349 | 0.78 | HTR3A (0.48) | HTR3AHTR3BADRA2AKCNE1ADRA2C |
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-2022115301-A1 | MODIFIED ISOINDOLINONES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2022-06-02 | — | — | WO | disclosed |