Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 18/20 | 0.49 |
| ▸ | HTR2B | P41595 | 18/20 | 0.49 |
| ▸ | HTR2C | P28335 | 17/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8828540 | 0.86 | HTR2A (0.49) | HTR2AHTR2BHTR2CL3MBTL1ADRB1 | |
| SCHEMBL8828324 | 0.86 | HTR2A (0.48) | HTR2AHTR2BHTR2CL3MBTL1ADRB1 | |
| SCHEMBL8828159 | 0.84 | HTR2A (0.47) | HTR2AHTR2BHTR2CL3MBTL1ADRB1 | |
| SCHEMBL9046497 | 0.84 | HTR2A (0.46) | HTR2AHTR2BHTR2CL3MBTL1ADRB1 | |
| SCHEMBL8828397 | 0.84 | L3MBTL1 (0.60) | HTR2AHTR2BHTR2CL3MBTL1ADRB1 | |
| SCHEMBL9045792 | 0.79 | L3MBTL1 (0.53) | HTR2AHTR2BHTR2CL3MBTL1OPRM1 | |
| SCHEMBL8828277 | 0.78 | KDM4E (0.66) | L3MBTL1DRD2DRD3 | |
| SCHEMBL14148791 | 0.75 | L3MBTL1 (0.61) | HTR2AHTR2BHTR2CL3MBTL1ADRB1 | |
| SCHEMBL29407319 | 0.75 | L3MBTL1 (0.61) | HTR2AHTR2BHTR2CL3MBTL1ADRB1 | |
| SCHEMBL8828234 | 0.74 | CYP3A4 (0.50) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0344577-B1 | Butenoic or propenoic acid derivatives | EISAI CO LTD (JP) | 1996-10-09 | — | — | EP | disclosed |
| EP-0344577-A2 | Butenoic or propenoic acid derivatives | Eisai Co., Ltd. (JP) | 1989-12-06 | — | — | EP | disclosed |