Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8800493 | 0.88 | PABPC1 (0.36) | PABPC1CTDSP1ADRA1DHTR1AADRA1B | |
| SCHEMBL9743283 | 0.75 | KDM4E (0.36) | KDM4EPABPC1CTDSP1ADRA1DHTR1A | |
| SCHEMBL9742312 | 0.75 | KDM4E (0.38) | KDM4EPABPC1CTDSP1 | |
| SCHEMBL9742112 | 0.74 | GAA (0.39) | KDM4EPABPC1CTDSP1HTR1AADRA1B | |
| SCHEMBL9747181 | 0.72 | KDM4E (0.36) | KDM4EPABPC1CTDSP1 | |
| SCHEMBL9743280 | 0.72 | KDM4E (0.36) | KDM4EPABPC1CTDSP1 | |
| SCHEMBL9235682 | 0.70 | ALDH1A1 (0.34) | — | |
| SCHEMBL9198915 | 0.70 | GAA (0.45) | KDM4EADRA1DHTR1AADRA1BADRA1A | |
| SCHEMBL9831774 | 0.70 | PABPC1 (0.34) | PABPC1CTDSP1ADRA1DHTR1AADRA1B | |
| SCHEMBL8527748 | 0.69 | PABPC1 (0.37) | PABPC1CTDSP1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5118702-A | FUNGICIDAL AND MICROBICIDAL SUBSTITUTED 1-AMINOMETHYL-3-ARYL-4-CYANO-PYRROLES | BAYER AKTIENGESELLSCHAFT (DE) | 1992-06-02 | — | — | US | disclosed |
| EP-0435043-A1 | Substituted 1-aminomethyl-3-aryl-4-cyano-pyrroles | BAYER AG (DE) | 1991-07-03 | — | — | EP | disclosed |