Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.45 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14003074 | 0.82 | GUCY1A1 (0.50) | GUCY1A1GUCY1B1HTTRAPGEF4ALDH1A1 | |
| SCHEMBL9741759 | 0.81 | TSHR (0.62) | GUCY1A1GUCY1B1HTTGAALMNA | |
| SCHEMBL20353496 | 0.81 | SMN1; SMN2 (0.42) | HTTALDH1A1GAALMNAMAPT | |
| SCHEMBL18235935 | 0.79 | KDM4E (0.43) | GAALMNAMAPTKDM4E | |
| SCHEMBL26378132 | 0.78 | KDM4E (0.47) | ALDH1A1GAALMNAMAPTKDM4E | |
| SCHEMBL9363410 | 0.77 | RAPGEF4 (0.52) | GUCY1A1GUCY1B1HTTRAPGEF4ALDH1A1 | |
| SCHEMBL17263168 | 0.76 | KAT2B (0.59) | ALDH1A1MAPTCYP3A4TSHR | |
| SCHEMBL18235917 | 0.76 | MAPT (0.59) | HTTALDH1A1GAALMNAMAPT | |
| SCHEMBL2499765 | 0.75 | CYP3A4 (0.64) | GUCY1A1GUCY1B1HTTRAPGEF4ALDH1A1 | |
| SCHEMBL13204732 | 0.74 | HTT (0.53) | GUCY1A1GUCY1B1HTTRAPGEF4ALDH1A1 |
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-2016183101-A1 | PALLADIUM-CATALYZED ARYLATION OF FLUOROALKYLAMINES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2016-11-17 | — | — | WO | disclosed |