Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 3/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | OGA | O60502 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9387516 | 0.70 | OPRM1 (0.57) | OPRM1OPRK1L3MBTL1SIGMAR1HDAC3 | |
| SCHEMBL2242813 | 0.67 | SIGMAR1 (0.48) | SIGMAR1ALDH1A1LMNA | |
| SCHEMBL17912362 | 0.66 | KAT2B (0.39) | CNR2POLB | |
| SCHEMBL3821802 | 0.66 | EPHX1 (0.49) | L3MBTL1KCNH2KMT2AALDH1A1LMNA | |
| Hexane SCHEMBL28019996 | 0.64 | EPHX2 (0.56) | CNR1CNR2L3MBTL1ALDH1A1 | |
| SCHEMBL28802088 | 0.64 | BCHE (0.51) | L3MBTL1ALDH1A1 | |
| SCHEMBL20794150 | 0.63 | GBA2 (0.35) | SIGMAR1OGAKMT2AMEN1LMNA | |
| SCHEMBL11938908 | 0.63 | ADRA1D (0.74) | SIGMAR1KCNH2KMT2AMEN1POLB | |
| SCHEMBL21559750 | 0.62 | GBA2 (0.37) | SIGMAR1OGAKMT2AMEN1POLB | |
| SCHEMBL26498896 | 0.62 | HRH3 (0.39) | KMT2AMEN1ALDH1A1 |
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 |