Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NPY1R | P25929 | 1/20 | 0.33 |
| ▸ | NPY2R | P49146 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5520596 | 0.82 | HRH3 (0.54) | CHRM1MCHR1HTR2AHRH3 | |
| SCHEMBL4690341 | 0.77 | SIGMAR1 (0.47) | HRH3CNR1CNR2ALDH1A1KDM4E | |
| SCHEMBL4696246 | 0.76 | SGK1 (0.48) | HRH3NPSR1ALDH1A1HPGDKDM4E | |
| SCHEMBL14545311 | 0.76 | CNR1 (0.40) | HRH3CNR1KDM1AALDH1A1HPGD | |
| SCHEMBL4695659 | 0.75 | USP8 (0.40) | HRH3CNR1CNR2KDM1AALDH1A1 | |
| SCHEMBL4747833 | 0.73 | USP8 (0.57) | CNR1CNR2ALDH1A1HPGDKDM4E | |
| SCHEMBL5530945 | 0.71 | ALDH1A1 (0.53) | CNR1CNR2NPSR1ALDH1A1HPGD | |
| SCHEMBL5521872 | 0.70 | USP8 (0.43) | CNR1CNR2ALDH1A1HPGDKDM4E | |
| SCHEMBL14523435 | 0.69 | CNR1 (0.40) | CNR1NPSR1ALDH1A1HPGDKDM4E | |
| SCHEMBL4695206 | 0.68 | CNR1 (0.46) | CNR1CNR2ALDH1A1HPGDKDM4E |
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-1871762-A2 | SUBTITUTED HETEROARYL CB1 ANTAGONISTS | NEUROGEN CORPORATION (US) | 2008-01-02 | — | — | EP | disclosed |
| WO-2006113704-A2 | SUBTITUTED HETEROARYL CB1 ANTAGONISTS | NEUROGEN CORPORATION (US) | 2006-10-26 | — | — | WO | disclosed |