Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | ADH4 | P08319 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| SCHEMBL3821799 | 0.80 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL1221462 | 0.80 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL28246290 | 0.80 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL2875169 | 0.77 | SLC6A2 (0.41) | L3MBTL1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL17786300 | 0.77 | SLC6A2 (0.41) | L3MBTL1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL1932588 | 0.76 | L3MBTL1 (0.41) | L3MBTL1ADH1CADH1AADH4CYP3A4 | |
| SCHEMBL3818321 | 0.76 | SLC6A4 (0.44) | SIGMAR1L3MBTL1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL18704813 | 0.75 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL13736459 | 0.74 | L3MBTL1 (0.35) | SIGMAR1L3MBTL1SLC6A2SLC6A4CYP3A4 | |
| SCHEMBL5510945 | 0.74 | L3MBTL1 (0.42) | L3MBTL1ADH1CADH1A |
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-2349269-A1 | 2,5-DISUBSTITUTED PIPERIDINE OREXIN RECEPTOR ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010048012-A1 | 2,5-DISUBSTITUTED PIPERIDINE OREXIN RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2010-04-29 | — | — | WO | disclosed |