Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.51 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.51 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL7252823 | 0.83 | GSK3A (0.57) | DDB1CRBNL3MBTL1EPHX2GSK3A | |
| SCHEMBL16085665 | 0.81 | GSK3A (0.54) | DDB1CRBNL3MBTL1EPHX2GSK3A | |
| SCHEMBL28499086 | 0.78 | SIGMAR1 (0.51) | DDB1CRBNL3MBTL1EPHX2GSK3A | |
| SCHEMBL9058751 | 0.78 | L3MBTL1 (0.59) | DDB1CRBNL3MBTL1EPHX2GSK3A | |
| SCHEMBL7546347 | 0.77 | APP (0.52) | DDB1CRBNL3MBTL1EPHX2GSK3A | |
| SCHEMBL2393298 | 0.77 | L3MBTL1 (0.63) | DDB1CRBNL3MBTL1GSK3AGSK3B | |
| SCHEMBL1488276 | 0.77 | L3MBTL1 (0.56) | DDB1CRBNL3MBTL1EPHX2GSK3A | |
| 2-Pyrrolidone SCHEMBL11025581 | 0.76 | L3MBTL1 (0.66) | DDB1CRBNL3MBTL1GSK3AGSK3B | |
| SCHEMBL9850086 | 0.74 | DDB1 (0.69) | DDB1CRBNL3MBTL1EPHX2GSK3A | |
| SCHEMBL1011633 | 0.74 | DDB1 (0.69) | DDB1CRBNL3MBTL1EPHX2GSK3A |
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-2049529-B1 | SUBSTITUTED DIAZEPAN OREXIN RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME (US) | 2010-08-11 | — | — | EP | disclosed |
| WO-2008008518-A1 | SUBSTITUTED DIAZEPAN OREXIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2008-01-17 | — | — | WO | disclosed |