Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | RPS6KA3 | P51812 | 3/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | LYN | P07948 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | MARK3 | P27448 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.36 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.36 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.36 |
| ▸ | CDC42BPA | Q5VT25 | 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 | |
|---|---|---|---|---|
| SCHEMBL16401560 | 0.90 | TDP1 (0.38) | KDM4EALDH1A1MAPTTDP1RPS6KA3 | |
| SCHEMBL702351 | 0.83 | HSD11B1 (0.43) | KDM4EALDH1A1MAPTNPC1GAA | |
| SCHEMBL701770 | 0.79 | GRM5 (0.37) | KDM4EALDH1A1MAPTNPC1GAA | |
| SCHEMBL16401580 | 0.75 | PRMT5 (0.40) | KDM4EALDH1A1MAPTNPC1GAA | |
| SCHEMBL11015928 | 0.75 | DHFR (0.39) | KDM4EALDH1A1MAPTNPC1GAA | |
| SCHEMBL16050773 | 0.74 | NR1H2 (0.42) | KDM4EALDH1A1MAPTCDK1GSK3B | |
| SCHEMBL4887183 | 0.72 | KDM4E (0.36) | KDM4EALDH1A1MAPTRPS6KA3PIM1 | |
| SCHEMBL7544327 | 0.71 | HPGD (0.36) | KDM4EALDH1A1MAPTNPC1GAA | |
| SCHEMBL11742762 | 0.71 | LMNA (0.45) | KDM4EALDH1A1MAPTNPC1GAA | |
| SCHEMBL31518204 | 0.71 | KDM4E (0.38) | KDM4EALDH1A1MAPTRPS6KA3CDK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1943004-B1 | RUTHENIUM-CATALYZED CYCLOADDITION OF ALKYNES AND ORGANIC AZIDES | SCRIPPS RESEARCH INST (US) | 2015-06-03 | — | — | EP | disclosed |
| EP-1943004-A2 | RUTHENIUM-CATALYZED CYCLOADDITION OF ALKYNES AND ORGANIC AZIDES | The Scripps Research Institute (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007041451-A2 | RUTHENIUM-CATALYZED CYCLOADDITION OF ALKYNES AND ORGANIC AZIDES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2007-04-12 | — | — | WO | disclosed |