Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 9/20 | 0.65 |
| ▸ | MEN1 | O00255 | 6/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL254528 | 0.88 | ALDH1A1 (0.56) | MAPTMEN1KMT2AALDH1A1MAPK1 | |
| Methylamine SCHEMBL9733678 | 0.84 | ALDH1A1 (0.58) | MAPTMEN1KMT2AALDH1A1MAPK1 | |
| Hydrogen Peroxide SCHEMBL28470548 | 0.84 | ALDH1A1 (0.55) | MAPTMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL3328543 | 0.84 | MAPT (0.79) | MAPTMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL4163474 | 0.84 | MAPT (0.79) | MAPTMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL8934655 | 0.82 | MAPT (0.76) | MAPTMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL8934649 | 0.82 | MAPT (0.76) | MAPTMEN1KMT2AALDH1A1MAPK1 | |
| Fluoride SCHEMBL29135589 | 0.82 | MAPT (0.76) | MAPTMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL2279013 | 0.79 | MCL1 (0.53) | MEN1KMT2AALDH1A1MAPK1HPGD | |
| SCHEMBL161647 | 0.79 | MAPT (0.66) | MAPTMEN1KMT2AALDH1A1MAPK1 |
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-2235029-B1 | NICKEL COMPLEXING COMPOUNDS CONTAINING DIARYL SULFIDE LIGANDS | BASF SE (DE) | 2011-09-21 | — | — | EP | disclosed |
| EP-2235029-A1 | NICKEL COMPLEXING COMPOUNDS CONTAINING DIARYL SULFIDE LIGANDS | BASF SE (DE) | 2010-10-06 | — | — | EP | disclosed |
| WO-2009083435-A1 | NICKEL COMPLEXING COMPOUNDS CONTAINING DIARYL SULFIDE LIGANDS | BASF SE (DE) | 2009-07-09 | — | — | WO | disclosed |