Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.46 |
| ▸ | APP | P05067 | 3/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.38 |
| ▸ | PLA2G4A | P47712 | 2/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14900871 | 0.97 | MAOB (0.49) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL18590858 | 0.95 | MAOB (0.47) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL19683537 | 0.94 | MAOB (0.54) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL24368895 | 0.92 | MAOB (0.49) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL14900889 | 0.92 | MAOB (0.51) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL24368621 | 0.90 | MAOB (0.47) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL24368565 | 0.90 | MAOB (0.47) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL24368561 | 0.90 | MAOB (0.47) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL24368556 | 0.90 | MAOB (0.47) | MAOBAPPESR1ESR2SHBG | |
| SCHEMBL24368894 | 0.90 | MAOB (0.47) | MAOBAPPESR1ESR2SHBG |
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-2017210072-A1 | ELECTROACTIVE COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2017-12-07 | — | — | WO | disclosed |