Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.37 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3947316 | 0.90 | CASR (0.41) | ALOX5PDK1MKNK1SLC16A3LMNA | |
| SCHEMBL3941835 | 0.89 | ALOX5 (0.46) | ALOX5LMNAMEN1KMT2ATSHR | |
| SCHEMBL3942439 | 0.88 | ALOX5 (0.38) | ALOX5MKNK1LMNAMEN1KMT2A | |
| SCHEMBL3948201 | 0.87 | SLC6A2 (0.37) | ALOX5PDK1MKNK1SLC16A3LMNA | |
| SCHEMBL3953649 | 0.87 | CASR (0.35) | ALOX5PDK1SLC16A3LMNAMEN1 | |
| SCHEMBL3944917 | 0.86 | BACE1 (0.41) | MEN1KMT2AADRB2ADRB1ADRB3 | |
| SCHEMBL3952000 | 0.86 | SLC16A3 (0.40) | ALOX5PDK1SLC16A3LMNAMEN1 | |
| SCHEMBL3951123 | 0.85 | BACE1 (0.41) | ALOX5MEN1KMT2ARAB9AKDM4E | |
| SCHEMBL3951861 | 0.85 | GRM4 (0.41) | NFKB1RAB9AKDM4E | |
| SCHEMBL3952248 | 0.84 | BACE1 (0.40) | ALOX5ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1718632-B1 | PYRIMIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | SANOFI AVENTIS (FR) | 2009-04-22 | — | — | EP | claimed |