Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM1 | Q13255 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.37 |
| ▸ | CLK1 | P49759 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10830418 | 0.85 | KDM4E (0.52) | TDP1MAPTTSHRPTGS1GAA | |
| SCHEMBL10830355 | 0.77 | GRM1 (0.38) | GRM1CYP1A2TDP1MEN1KMT2A | |
| SCHEMBL10830071 | 0.73 | CA12 (0.53) | MAPTCLK1DYRK1ADYRK1BGAA | |
| SCHEMBL11162284 | 0.73 | CA12 (0.57) | CYP1A2MEN1KMT2AMAPTTSHR | |
| SCHEMBL29555158 | 0.73 | KDM4E (0.64) | GRM1CYP1A2TDP1MEN1KMT2A | |
| SCHEMBL71388 | 0.73 | KDM4E (0.64) | GRM1CYP1A2TDP1MEN1KMT2A | |
| SCHEMBL10042363 | 0.73 | GAA (0.52) | GRM1CYP1A2TDP1MEN1KMT2A | |
| SCHEMBL23592021 | 0.71 | TSHR (0.50) | CYP1A2TDP1KMT2AMAPTTSHR | |
| SCHEMBL5328242 | 0.71 | TSHR (0.44) | TDP1MEN1KMT2AMAPTTSHR | |
| SCHEMBL1805871 | 0.71 | LCK (0.53) | TDP1MAPTTSHRCASP1TRPA1 |
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-0066518-B1 | COMPOUNDS AND METHODS FOR TREATING DEPRESSION | MERRELL DOW FRANCE ET CIE (FR) | 1986-06-11 | — | — | EP | disclosed |
| EP-0066518-A2 | Compounds and methods for treating depression | MERRELL DOW FRANCE ET CIE (FR) | 1982-12-08 | — | — | EP | disclosed |