Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 2/20 | 0.50 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.50 |
| ▸ | PGR | P06401 | 2/20 | 0.49 |
| ▸ | CMA1 | P23946 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 7/20 | 0.47 |
| ▸ | HTR2C | P28335 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17080919 | 0.86 | HTR1A (0.51) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL1325447 | 0.83 | HTR1A (0.49) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL9684052 | 0.82 | HTR1A (0.48) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL9204486 | 0.81 | MAPT (0.59) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL7765507 | 0.81 | PDE3B (0.50) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL9685648 | 0.80 | CMA1 (0.56) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL9992658 | 0.80 | PDE3B (0.49) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL4882695 | 0.79 | HTR1A (0.51) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL9684901 | 0.79 | PDE3B (0.51) | PDE3BPDE3APGRCMA1HTR1A | |
| SCHEMBL7332557 | 0.79 | HTR1A (0.51) | PDE3BPDE3APGRCMA1HTR1A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1072655-C | New heterocyclic aminomethyl compounds, process for preparing them and pharmaceutical compositions containing them | ADIR (FR) | 2001-10-10 | — | — | CN | disclosed |
| EP-0841330-B1 | Aminomethyl heterocyclic derivatives, process of their preparation and pharmaceutical compositions containing them | ADIR (FR) | 2001-06-27 | — | — | EP | disclosed |
| US-5919784-A | ANXIETY, DEPRESSION | ADIR ET COMPAGNIE (FR) | 1999-07-06 | — | — | US | disclosed |
| CN-1182083-A | New heterocyclic aminomethyl compounds, process for preparing them and pharmaceutical compositions containing them | ADIR (FR) | 1998-05-20 | — | — | CN | disclosed |
| EP-0841330-A1 | Aminomethyl heterocyclic derivatives, process of their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1998-05-13 | — | — | EP | disclosed |