Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16679797 | 0.89 | MAOA (0.37) | MAOAMAOB | |
| SCHEMBL16679916 | 0.83 | IDO1 (0.34) | MAOB | |
| SCHEMBL31716590 | 0.83 | IDO1 (0.34) | MAOB | |
| SCHEMBL613761 | 0.81 | ALDH1A1 (0.46) | ALDH1A1 | |
| SCHEMBL30374708 | 0.81 | ALDH1A1 (0.46) | ALDH1A1 | |
| SCHEMBL4295010 | 0.76 | TRPV1 (0.34) | ALDH1A1 | |
| SCHEMBL3396094 | 0.74 | AKR1B1 (0.33) | — | |
| SCHEMBL18003106 | 0.72 | MAOB (0.42) | ALDH1A1MAOAMAOB | |
| SCHEMBL25368195 | 0.72 | CYP4F2 (0.44) | MAOAMAOB | |
| SCHEMBL12487338 | 0.72 | LOXL2 (0.38) | MAOAMAOB |
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-3063143-A1 | AMINOHETEROARYL BENZAMIDES AS KINASE INHIBITORS | Novartis AG (CH) | 2016-09-07 | — | — | EP | disclosed |
| WO-2015066188-A1 | AMINOHETEROARYL BENZAMIDES AS KINASE INHIBITORS | NOVARTIS AG (CH) | 2015-05-07 | — | — | WO | disclosed |