Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | ATM | Q13315 | 2/20 | 0.57 |
| ▸ | APP | P05067 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.53 |
| ▸ | CTSS | P25774 | 3/20 | 0.52 |
| ▸ | CTSK | P43235 | 2/20 | 0.52 |
| ▸ | CTSL | P07711 | 1/20 | 0.52 |
| ▸ | CTSB | P07858 | 1/20 | 0.52 |
| ▸ | BACE1 | P56817 | 2/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.49 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.49 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.49 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.49 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.49 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8532232 | 0.89 | ATM (0.69) | ATMAPPMEN1KMT2AKLK5 | |
| SCHEMBL271855 | 0.87 | ATM (0.71) | CYP3A4MAPK1ATMAPPKLK5 | |
| SCHEMBL1529562 | 0.87 | ATM (0.71) | CYP3A4MAPK1ATMAPPKLK5 | |
| SCHEMBL257912 | 0.87 | ATM (0.71) | CYP3A4MAPK1ATMAPPKLK5 | |
| SCHEMBL7349961 | 0.87 | ATM (0.58) | CYP3A4MAPK1ATMAPPKLK5 | |
| SCHEMBL13669577 | 0.85 | CTSS (0.67) | CYP3A4MAPK1ATMAPPCTSS | |
| SCHEMBL7323342 | 0.84 | CYP3A4 (0.60) | CYP3A4MAPK1CTSSCTSKCTSL | |
| SCHEMBL8130179 | 0.84 | KMT2A (0.67) | ATMAPPMEN1KMT2AKLK5 | |
| SCHEMBL29602242 | 0.84 | KMT2A (0.67) | ATMAPPMEN1KMT2AKLK5 | |
| SCHEMBL27413971 | 0.84 | REN (0.63) | CYP3A4MAPK1ATMCTSSCTSK |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0503561-B1 | Method for the diastereoselective reductive pinacol coupling of homochiral alpha aminoaldehydes | HOECHST AG (DE) | 1998-10-28 | — | — | EP | disclosed |
| EP-0541946-B1 | Process for diastereo selective reductive pinacol-coupling of homochiral alpha-aminoaldehydes | HOECHST AG (DE) | 1996-07-17 | — | — | EP | disclosed |
| US-5519113-A | Process for the diastereoselective reductive pinacol coupling of homochiral α-aminoaldehydes | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-05-21 | — | — | US | disclosed |
| US-5463124-A | Treating with niobium trichloride-dimethoxyethane complex and simultaneously controlling all four corners of chirality | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-10-31 | — | — | US | disclosed |
| EP-0541946-A1 | Process for diastereo selective reductive pinacol-coupling of homochiral alpha-aminoaldehydes | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-05-19 | — | — | EP | disclosed |
| EP-0503561-A2 | Method for the diastereoselective reductive pinacol coupling of homochiral alpha aminoaldehydes | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-09-16 | — | — | EP | disclosed |