Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | KDM6B | O15054 | 1/20 | 0.38 |
| ▸ | KDM5C | P41229 | 1/20 | 0.38 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.38 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL71518 | 0.93 | NPSR1 (0.59) | NPSR1L3MBTL1KDM4EALDH1A1KDM4C | |
| SCHEMBL24994251 | 0.85 | NPSR1 (0.46) | NPSR1L3MBTL1KDM4EALDH1A1KDM4C | |
| SCHEMBL361255 | 0.84 | KDM4E (0.58) | NPSR1L3MBTL1KDM4EALDH1A1KDM4C | |
| SCHEMBL31027302 | 0.84 | KDM4E (0.58) | NPSR1L3MBTL1KDM4EALDH1A1KDM4C | |
| SCHEMBL277948 | 0.83 | PDE3B (0.45) | NPSR1L3MBTL1KDM4EALDH1A1TSHR | |
| SCHEMBL871602 | 0.80 | NPSR1 (0.50) | NPSR1L3MBTL1KDM4EALDH1A1KDM4C | |
| SCHEMBL162243 | 0.80 | L3MBTL1 (0.53) | NPSR1L3MBTL1KDM4EALDH1A1KDM4C | |
| SCHEMBL29409978 | 0.80 | NPSR1 (0.50) | NPSR1L3MBTL1KDM4EALDH1A1KDM4C | |
| SCHEMBL360639 | 0.80 | NPSR1 (0.50) | NPSR1L3MBTL1KDM4EALDH1A1KDM4C | |
| SCHEMBL261104 | 0.78 | NPSR1 (0.48) | NPSR1L3MBTL1KDM4EALDH1A1SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016101119-A1 | FUSED HETEROARYL DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2016-06-30 | — | — | WO | disclosed |
| US-5098462-A | Herbicides | SANDOZ LTD. (CH) | 1992-03-24 | — | — | US | disclosed |
| US-5098466-A | Herbicides | SANDOZ LTD. (CH) | 1992-03-24 | — | — | US | disclosed |