Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 5/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | PTGES | O14684 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21065171 | 1.00 | LMNA (0.47) | LMNATSHRHCRTR1HCRTR2MAPT | |
| SCHEMBL21065056 | 0.89 | HCRTR1 (0.46) | LMNATSHRHCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL21065054 | 0.89 | HCRTR1 (0.46) | LMNATSHRHCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL21065114 | 0.88 | TSHR (0.50) | LMNATSHRHCRTR1HCRTR2MAPT | |
| SCHEMBL21065113 | 0.88 | TSHR (0.50) | LMNATSHRHCRTR1HCRTR2MAPT | |
| SCHEMBL21065140 | 0.82 | TSHR (0.44) | LMNATSHRHCRTR1HCRTR2MAPT | |
| SCHEMBL21065142 | 0.82 | TSHR (0.44) | LMNATSHRHCRTR1HCRTR2MAPT | |
| SCHEMBL17063850 | 0.82 | HCRTR1 (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL17063849 | 0.82 | HCRTR1 (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL21065149 | 0.81 | TSHR (0.49) | LMNATSHRHCRTR1HCRTR2MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2906553-B1 | OREXIN RECEPTOR ANTAGONISTS WHICH ARE [ORTHO BI (HETERO )ARYL]-[2-(META BI (HETERO)ARYL)-PYRROLIDIN-1-YL]-METHANONE DERIVATIVES | IDORSIA PHARMACEUTICALS LTD (CH) | 2019-06-26 | — | — | EP | disclosed |