Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 9/20 | 0.62 |
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3399698 | 0.89 | HTR2C (0.78) | HTR2CCES2CNR1PARP1ALDH1A1 | |
| SCHEMBL3396773 | 0.88 | HTR2C (0.59) | HTR2CCES2CNR1PARP1ALDH1A1 | |
| SCHEMBL3402333 | 0.86 | HTR2C (0.57) | HTR2CCES2CNR1PARP1POLB | |
| SCHEMBL3405384 | 0.85 | HTR2C (0.62) | HTR2CCES2CNR1PARP1SMN1; SMN2 | |
| SCHEMBL3400053 | 0.84 | HTR2C (0.58) | HTR2CCES2CNR1PARP1ALDH1A1 | |
| SCHEMBL3403006 | 0.83 | HTR2C (0.49) | HTR2CCES2CNR1PARP1ALDH1A1 | |
| SCHEMBL3403824 | 0.83 | HTR2C (0.57) | HTR2CCES2CNR1PARP1ALDH1A1 | |
| SCHEMBL3402132 | 0.83 | HTR2C (0.60) | HTR2CCES2CNR1PARP1POLB | |
| SCHEMBL13309952 | 0.82 | HTR2C (0.60) | HTR2CCES2CNR1ALDH1A1KDM4E | |
| SCHEMBL3400087 | 0.82 | HTR2C (0.47) | HTR2CCES2CNR1PARP1ALDH1A1 |
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 |