Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | THRA | P10827 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3405357 | 0.91 | CNR1 (0.54) | CNR1THRATHRBHRH3ROCK1 | |
| SCHEMBL3401619 | 0.90 | CNR1 (0.53) | CNR1THRATHRBHRH3ROCK1 | |
| SCHEMBL3402546 | 0.90 | CNR1 (0.53) | CNR1THRATHRBGSK3BHRH3 | |
| SCHEMBL3400865 | 0.89 | CNR1 (0.55) | CNR1THRATHRBGSK3BDYRK1A | |
| SCHEMBL3404564 | 0.88 | CFTR (0.52) | CNR1THRATHRBTARBP2HTR2C | |
| SCHEMBL3404859 | 0.87 | CNR1 (0.47) | CNR1THRATHRBGSK3BDYRK1A | |
| SCHEMBL3404031 | 0.85 | HTR2C (0.47) | CNR1HRH3HTR2CALDH1A1KDM4E | |
| SCHEMBL3402351 | 0.85 | CNR1 (0.45) | CNR1THRATHRBGSK3BDYRK1A | |
| SCHEMBL3405916 | 0.85 | CNR1 (0.51) | CNR1THRATHRBGSK3BDYRK1A | |
| SCHEMBL3405399 | 0.83 | CNR1 (0.57) | CNR1THRATHRBHRH3TARBP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7728009-B1 | Thiazole amides, imidazole amides and related analogues | NEUROGEN CORPORATION (US) | 2010-06-01 | — | — | US | disclosed |
| US-7728009-B1 | Thiazole amides, imidazole amides and related analogues | NEUROGEN CORPORATION (US) | 2010-06-01 | — | — | US | disclosed |
| US-7728009-B1 | Thiazole amides, imidazole amides and related analogues | NEUROGEN CORPORATION (US) | 2010-06-01 | — | — | US | disclosed |