Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.55 |
| ▸ | MAOB | P27338 | 2/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.55 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | DRD1 | P21728 | 2/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD5 | P21918 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20214588 | 1.00 | MAOA (0.55) | MAOAMAOBSLC6A4SIRT6RAB9A | |
| SCHEMBL2204654 | 0.92 | MAOA (0.67) | MAOAMAOBSLC6A4SIRT6RAB9A | |
| SCHEMBL20939331 | 0.92 | MAOA (0.67) | MAOAMAOBSLC6A4SIRT6RAB9A | |
| SCHEMBL29651228 | 0.92 | MAOA (0.67) | MAOAMAOBSLC6A4SIRT6RAB9A | |
| SCHEMBL14993936 | 0.87 | SIRT6 (0.55) | MAOAMAOBSLC6A4SIRT6RAB9A | |
| SCHEMBL2574136 | 0.86 | SIRT6 (0.57) | MAOAMAOBSLC6A4SIRT6RAB9A | |
| SCHEMBL21256017 | 0.82 | MAOB (0.79) | MAOAMAOBSLC6A4DRD1DRD2 | |
| SCHEMBL20214659 | 0.77 | MAOA (0.50) | MAOAMAOBSLC6A4RAB9ANPC1 | |
| SCHEMBL29651191 | 0.77 | MAOA (0.50) | MAOAMAOBSLC6A4RAB9ADRD2 | |
| SCHEMBL24729539 | 0.77 | ABCB1 (0.54) | RAB9ANPC1LMNAALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2222647-A1 | FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS | Cephalon, Inc. (US) | 2010-09-01 | — | — | EP | disclosed |
| WO-2008051547-A1 | FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS | CEPHALON, INC. (US) | 2008-05-02 | — | — | WO | disclosed |