Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5195267 | 0.90 | ALDH1A1 (0.41) | ALDH1A1KDM4EKMT2AMEN1NPC1 | |
| SCHEMBL5193895 | 0.84 | KDM4E (0.48) | ALDH1A1KDM4EKMT2AMEN1RAB9A | |
| SCHEMBL5195794 | 0.81 | ALDH1A1 (0.44) | ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL5190948 | 0.80 | TSHR (0.43) | ALDH1A1KDM4EHTTMAPK1 | |
| SCHEMBL5193468 | 0.80 | ALDH1A1 (0.52) | ALDH1A1KDM4EKMT2AMEN1HTT | |
| SCHEMBL5193499 | 0.80 | FAAH (0.52) | ALDH1A1KDM4EKMT2AMEN1HTT | |
| SCHEMBL5190962 | 0.79 | ALDH1A1 (0.44) | ALDH1A1KDM4EKMT2AMEN1HTT | |
| SCHEMBL5208487 | 0.77 | NOS2 (0.39) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL5193950 | 0.77 | CCR2 (0.46) | KMT2AMEN1MAPK1 | |
| SCHEMBL5193934 | 0.76 | ALDH1A1 (0.53) | ALDH1A1KDM4EKMT2AMEN1HTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0968206-B8 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX INC (US) | 2007-01-24 | — | — | EP | disclosed |
| EP-0968206-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 2000-01-05 | — | — | EP | disclosed |
| WO-1998037079-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1998-08-27 | — | — | WO | disclosed |