Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15099897 | 0.79 | KDM4E (0.37) | KDM4EL3MBTL1MAPTNPC1MAPK1 | |
| SCHEMBL2273523 | 0.74 | NQO1 (0.41) | KDM4EALDH1A1PDE10APDE4APDE4B | |
| SCHEMBL18560621 | 0.74 | KDM4E (0.33) | KDM4EL3MBTL1MAPTALDH1A1NQO2 | |
| SCHEMBL15090987 | 0.73 | NOS3 (0.34) | KDM4ENPC1RAB9AGAAALDH1A1 | |
| SCHEMBL15091095 | 0.71 | MEN1 (0.42) | KDM4EL3MBTL1MAPTNPC1RAB9A | |
| SCHEMBL9810196 | 0.71 | MCHR1 (0.52) | MCHR1NCF1KDM4EL3MBTL1MAPT | |
| SCHEMBL15091050 | 0.70 | POLB (0.40) | MCHR1NCF1KDM4EMAPTNPC1 | |
| SCHEMBL22222454 | 0.70 | KDM4E (0.40) | MCHR1KDM4EL3MBTL1MAPTTHRB | |
| SCHEMBL26137569 | 0.70 | GABRP (0.42) | ALDH1A1LMNANOS1NOS3NOS2 | |
| SCHEMBL359862 | 0.70 | MCHR1 (0.50) | MCHR1NCF1KDM4EL3MBTL1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009020642-A1 | PYRIDINE CARBOXAMIDE OREXIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2009-02-12 | — | — | WO | disclosed |