Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 14/20 | 0.49 |
| ▸ | HTR3A | P46098 | 14/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.45 |
| ▸ | HTR6 | P50406 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | HRH2 | P25021 | 2/20 | 0.44 |
| ▸ | HTR1B | P28222 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | HTR7 | P34969 | 2/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.44 |
| ▸ | HTR5A | P47898 | 2/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6670342 | 0.89 | CA12 (0.46) | ALDH1A1 | |
| Caldaret SCHEMBL1650574 | 0.88 | ALDH1A1 (0.52) | HTR1AHTR3AALDH1A1ADRB1HTR6 | |
| Caldaret SCHEMBL2853338 | 0.87 | ALDH1A1 (0.51) | HTR1AHTR3AALDH1A1ADRB1HTR6 | |
| Caldaret SCHEMBL29711318 | 0.87 | ALDH1A1 (0.51) | HTR1AHTR3AALDH1A1ADRB1HTR6 | |
| Caldaret SCHEMBL3135751 | 0.87 | ALDH1A1 (0.51) | HTR1AHTR3AALDH1A1ADRB1HTR6 | |
| Caldaret SCHEMBL3139412 | 0.87 | ALDH1A1 (0.51) | HTR1AHTR3AALDH1A1ADRB1HTR6 | |
| SCHEMBL29232278 | 0.85 | CA12 (0.50) | HTR1AHTR3AALDH1A1ADRB1HTR6 | |
| SCHEMBL14538085 | 0.84 | ALDH1A1 (0.67) | HTR1AHTR3AALDH1A1HTR6 | |
| SCHEMBL8217660 | 0.83 | MAPT (0.45) | HTR1AHTR3AALDH1A1HTR6ADRB2 | |
| Caldaret SCHEMBL3139464 | 0.80 | ALDH1A1 (0.45) | HTR1AHTR3AALDH1A1ADRB1HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| JP-10298077-A | — | — | None | — | — | JP | disclosed |
| JP-H10298077-A | AGENT FOR TREATING AND PREVENTING CARDIAC MYOPATHY | MITSUBISHI CHEM CORP | 1998-11-10 | — | — | JP | disclosed |