Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 12/20 | 0.47 |
| ▸ | MAOB | P27338 | 12/20 | 0.47 |
| ▸ | KDM1A | O60341 | 12/20 | 0.47 |
| ▸ | RCOR1 | Q9UKL0 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2228338 | 0.90 | KDM1A (0.52) | MAOAMAOBKDM1ARCOR1 | |
| SCHEMBL1421527 | 0.90 | KDM1A (0.52) | MAOAMAOBKDM1ARCOR1 | |
| SCHEMBL2225021 | 0.90 | KDM1A (0.52) | MAOAMAOBKDM1ARCOR1 | |
| SCHEMBL2352598 | 0.90 | KDM1A (0.52) | MAOAMAOBKDM1ARCOR1 | |
| SCHEMBL11865318 | 0.85 | KDM1A (0.44) | MAOAMAOBKDM1ARCOR1 | |
| SCHEMBL2228579 | 0.84 | SLC6A2 (0.39) | KDM1ARCOR1 | |
| SCHEMBL2225309 | 0.84 | SLC6A2 (0.39) | KDM1ARCOR1 | |
| SCHEMBL2228553 | 0.84 | SLC6A2 (0.39) | KDM1ARCOR1 | |
| Hydrochloric Acid SCHEMBL11860269 | 0.84 | KDM1A (0.45) | MAOAMAOBKDM1ARCOR1 | |
| SCHEMBL2226673 | 0.81 | SLC6A2 (0.41) | MAOAMAOBKDM1ARCOR1 |
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-2148857-A1 | PYRROLIDINE DERIVATIVES AS DUAL NK1/NK3 RECEPTOR ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2010-02-03 | — | — | EP | disclosed |
| WO-2008128891-A1 | PYRROLIDINE DERIVATIVES AS DUAL NK1/NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-10-30 | — | — | WO | disclosed |