Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.30 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL4554607 | 0.79 | L3MBTL3 (0.38) | L3MBTL3L3MBTL1 | |
| SCHEMBL4555362 | 0.73 | L3MBTL3 (0.43) | L3MBTL3L3MBTL1CYP2C9 | |
| SCHEMBL4555088 | 0.72 | GNAI3 (0.32) | KDM4EMAPTATMALOX15 | |
| SCHEMBL4433461 | 0.72 | L3MBTL3 (0.38) | OPRK1L3MBTL3ALDH1A1TSHR | |
| SCHEMBL4555067 | 0.69 | L3MBTL3 (0.38) | L3MBTL3L3MBTL1KDM1A | |
| SCHEMBL3486727 | 0.69 | PSMB5 (0.33) | PKMOPRK1KDM4EMAPTATM | |
| SCHEMBL4553619 | 0.68 | LRRK2 (0.38) | L3MBTL3L3MBTL1 | |
| SCHEMBL4555173 | 0.66 | L3MBTL3 (0.35) | L3MBTL3L3MBTL1ALDH1A1 | |
| SCHEMBL4553277 | 0.65 | MAPT (0.35) | KDM4EMAPTL3MBTL3L3MBTL1ALDH1A1 | |
| SCHEMBL4555483 | 0.64 | L3MBTL3 (0.36) | L3MBTL3L3MBTL1 |
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 |