Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 2/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PPARD | Q03181 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7998189 | 0.92 | MAPT (0.39) | PDCD1CD274HTR1BMAPTKDM4E | |
| SCHEMBL7996100 | 0.86 | HTR1B (0.42) | HTR1BMAPTKDM4EGAAMAPK1 | |
| SCHEMBL16955136 | 0.84 | PDCD1 (0.44) | PDCD1CD274HTR1BMAPTKDM4E | |
| SCHEMBL18727936 | 0.84 | CD274 (0.46) | PDCD1CD274KDM4EMAPK1TDP1 | |
| SCHEMBL1662732 | 0.83 | PDCD1 (0.43) | PDCD1CD274HTR1BMAPTKDM4E | |
| SCHEMBL7997520 | 0.83 | HTR1B (0.50) | PDCD1CD274HTR1BMAPTKDM4E | |
| SCHEMBL6768985 | 0.82 | KDM4E (0.51) | HTR1BMAPTKDM4EGAAMAPK1 | |
| SCHEMBL2354192 | 0.80 | PDCD1 (0.47) | PDCD1CD274MAPTKDM4EGAA | |
| SCHEMBL7975336 | 0.79 | ALDH1A1 (0.44) | PDCD1CD274HTR1BMAPTKDM4E | |
| SCHEMBL8710166 | 0.78 | ALDH1A1 (0.35) | PDCD1CD274MAPTKDM4EGAA |
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-2001034578-A1 | COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY | ASTRAZENECA AB (SE) | 2001-05-17 | — | — | WO | disclosed |