Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.76 |
| ▸ | MAPT | P10636 | 5/20 | 0.76 |
| ▸ | THRB | P10828 | 3/20 | 0.76 |
| ▸ | MEN1 | O00255 | 3/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.76 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.76 |
| ▸ | RAB9A | P51151 | 2/20 | 0.76 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.76 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.76 |
| ▸ | FGB | P02675 | 1/20 | 0.76 |
| ▸ | POLB | P06746 | 1/20 | 0.76 |
| ▸ | PPARG | P37231 | 1/20 | 0.76 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.76 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.57 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.57 |
| ▸ | G6PD | P11413 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL498594 | 1.00 | ALDH1A1 (0.76) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL498449 | 1.00 | ALDH1A1 (0.76) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL2303569 | 0.87 | MAPT (1.00) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL498666 | 0.86 | MEN1 (0.79) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL11134106 | 0.86 | MAPT (0.73) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL11690019 | 0.80 | MAPT (0.59) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL11246302 | 0.79 | ALDH1A1 (0.66) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL3909101 | 0.79 | MAPT (0.64) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL29390741 | 0.78 | THRB (1.00) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL125495 | 0.78 | THRB (1.00) | ALDH1A1MAPTTHRBMEN1KMT2A |
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-0025926-B1 | PROCESS FOR THE PREPARATION OF MONOAROYLATED 1,4-DIAMINO ANTHRAQUINONES | BAYER AG (DE) | 1982-11-24 | — | — | EP | disclosed |
| US-4324732-A | IN PRESENCE OF TERITIARY ALIPHATIC AMINOALCOHOL AND/OR QUARTERNARY AMMONIUM COMPOUND | BAYER AKTIENGESELLSCHAFT (DE) | 1982-04-13 | — | — | US | disclosed |
| EP-0025926-A1 | Process for the preparation of monoaroylated 1,4-diamino anthraquinones | BAYER AG (DE) | 1981-04-01 | — | — | EP | disclosed |