Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 6/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 6/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 6/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 6/20 | 0.32 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4434104 | 0.80 | CYP1A2 (0.39) | HRH4CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL10276684 | 0.73 | HCRTR1 (0.41) | HRH4ALDH1A1 | |
| SCHEMBL4937062 | 0.68 | BPTF (0.51) | HRH4CHRNB2CHRNA4ALDH1A1CYP1A2 | |
| SCHEMBL3652745 | 0.67 | GPR119 (0.35) | GPR119 | |
| Hydrochloric Acid SCHEMBL4818046 | 0.66 | BPTF (0.50) | HRH4CHRNB2CHRNA4ALDH1A1CYP1A2 | |
| SCHEMBL4555485 | 0.66 | GPR119 (0.39) | GPR119ALDH1A1 | |
| SCHEMBL20898548 | 0.66 | LRRK2 (0.45) | MMP2ADAMTS5 | |
| SCHEMBL4431799 | 0.66 | GPR119 (0.43) | GPR119ALDH1A1L3MBTL3L3MBTL1 | |
| SCHEMBL17884822 | 0.65 | MMP2 (0.42) | MMP2ADAMTS5 | |
| SCHEMBL4554925 | 0.65 | GPR119 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4GPR119 |
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-2121661-A1 | BIPIPERIDINYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | Merck & Co., Inc. (US) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008085316-A1 | BIPIPERIDINYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | MERCK & CO., INC. (US) | 2008-07-17 | — | — | WO | disclosed |