Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | MAOB | P27338 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11423954 | 1.00 | ALDH1A1 (0.57) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL4666400 | 1.00 | ALDH1A1 (0.57) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL11415717 | 1.00 | ALDH1A1 (0.57) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL10617722 | 1.00 | ALDH1A1 (0.57) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL31352955 | 1.00 | ALDH1A1 (0.57) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL30788697 | 1.00 | ALDH1A1 (0.57) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL12190723 | 0.98 | ALDH1A1 (0.55) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL13822619 | 0.95 | MAOB (0.56) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL11417695 | 0.91 | MAOB (0.59) | ALDH1A1HPGDMAOBKDM4EHTT | |
| SCHEMBL11418242 | 0.91 | MAOB (0.59) | ALDH1A1HPGDMAOBKDM4EHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4226801-A | Terminated bis(3,4-dicyanophenoxy) alkanes | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1980-10-07 | — | — | US | disclosed |