Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 9/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3404961 | 0.94 | HTR2C (0.45) | HTR2CCES2PARP1ALDH1A1HTR2A | |
| SCHEMBL3401007 | 0.93 | HTR2C (0.45) | HTR2CCES2PARP1ALDH1A1NPC1 | |
| SCHEMBL3401076 | 0.93 | HTR2C (0.45) | HTR2CCES2PARP1POLBCNR1 | |
| SCHEMBL3402512 | 0.91 | HTR2C (0.43) | HTR2CCES2PARP1ALDH1A1POLB | |
| SCHEMBL3400849 | 0.91 | HTR2C (0.45) | HTR2CCES2PARP1ALDH1A1NPC1 | |
| SCHEMBL3402545 | 0.90 | HTR2C (0.54) | HTR2CCES2PARP1ALDH1A1POLB | |
| SCHEMBL3405924 | 0.89 | HTR2C (0.45) | HTR2CCES2PARP1ALDH1A1POLB | |
| SCHEMBL3406091 | 0.88 | HTR2C (0.42) | HTR2CCES2ALDH1A1HTR1A | |
| SCHEMBL3402581 | 0.87 | CNR1 (0.47) | HTR2CCES2PARP1ALDH1A1CNR1 | |
| SCHEMBL3403945 | 0.85 | HTR2C (0.52) | HTR2CCES2PARP1ALDH1A1POLB |
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 4 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 |
| WO-2006089076-A9 | THIAZOLE AMIDES, IMIDAZOLE AMIDES AND RELATED ANALOGUES | NEUROGEN CORP (US) | 2007-04-26 | — | — | WO | disclosed |