Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | HTR1E | P28566 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | HTR5A | P47898 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4260439 | 0.83 | KDM1A (0.51) | KDM1ATUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL1380700 | 0.83 | KDM1A (0.51) | KDM1ATUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL1380697 | 0.83 | KDM1A (0.51) | KDM1ATUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL2826447 | 0.83 | KDM1A (0.51) | KDM1ATUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL10192778 | 0.80 | SLC6A2 (0.45) | — | |
| SCHEMBL18423957 | 0.79 | CYP2C9 (0.38) | KDM1AMAPK1HTR2AHTR2BALDH1A1 | |
| SCHEMBL5334908 | 0.79 | CA2 (0.51) | KDM1AALDH1A1TSHR | |
| SCHEMBL5334911 | 0.79 | CA2 (0.51) | KDM1AALDH1A1TSHR | |
| SCHEMBL8333221 | 0.76 | TUBB4A (0.43) | KDM1AMAPK1SMN1; SMN2HTR2AHTR2B | |
| SCHEMBL4259945 | 0.75 | KDM1A (0.51) | KDM1AMAPK1DPP4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1833782-B1 | CYCLOALKYLAMINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2009-04-08 | — | — | EP | disclosed |