Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 4/20 | 0.32 |
| ▸ | MAOB | P27338 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10875879 | 0.84 | HSD11B1 (0.39) | HSD11B1MAOAMAOBALDH1A1CYP3A4 | |
| SCHEMBL7330891 | 0.82 | KCNJ1 (0.37) | MAPT | |
| SCHEMBL7219338 | 0.81 | MAPT (0.33) | HSD11B1KDM4EALDH1A1MAPTHTT | |
| SCHEMBL7323975 | 0.78 | ALDH1A1 (0.36) | ALDH1A1MAPTCYP3A4 | |
| SCHEMBL2316537 | 0.74 | CYP2D6 (0.33) | — | |
| SCHEMBL4367842 | 0.73 | PDE1C (0.34) | MAOAMAOB | |
| SCHEMBL5790163 | 0.73 | MAOA (0.38) | HSD11B1MAOAMAOBMAPTKDM1A | |
| SCHEMBL14685926 | 0.72 | — | — | |
| SCHEMBL394270 | 0.71 | MAOA (0.41) | HSD11B1MAOAMAOBKDM1ACYP3A4 | |
| SCHEMBL22089975 | 0.71 | — | — |
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-2010097815-A2 | A TWO COMPONENT RECYCLABLE HETEROGENEOUS CATALYST, PROCESS FOR PREPARATION THEREOF AND ITS USE FOR PREPARATION OF AMINES | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2010-09-02 | — | — | WO | disclosed |