Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.30 |
| ▸ | KDM4C | Q9H3R0 | 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 | |
|---|---|---|---|---|
| SCHEMBL8117268 | 0.81 | MAOA (0.44) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL46305 | 0.81 | CCR1 (0.52) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL2644955 | 0.79 | MAOA (0.39) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL29407430 | 0.79 | MAOA (0.36) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL2644959 | 0.79 | MAOA (0.39) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL1557876 | 0.79 | MAOA (0.36) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL23576574 | 0.79 | EPHX2 (0.41) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL19245816 | 0.77 | LMNA (0.38) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL5899040 | 0.77 | MAOA (0.35) | MAOAMAOBEPHX2PDE10APPARA | |
| SCHEMBL13771819 | 0.77 | NPC1 (0.44) | MAOAMAOBEPHX2PDE10ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011090935-A1 | PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-07-28 | — | — | WO | disclosed |
| WO-2008108988-A1 | ANTIMICROBIAL HETEROCYCLIC COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS | MICURX PHARMACEUTICALS, INC. (US) | 2008-09-12 | — | — | WO | disclosed |