Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.53 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.51 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.51 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 3/20 | 0.49 |
| ▸ | CA9 | Q16790 | 3/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPN | P05981 | 2/20 | 0.47 |
| ▸ | PLAU | P00749 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL130104 | 1.00 | ALDH1A1 (0.53) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL1464202 | 1.00 | ALDH1A1 (0.53) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL29500256 | 1.00 | ALDH1A1 (0.53) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL472429 | 1.00 | ALDH1A1 (0.53) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL292958 | 1.00 | ALDH1A1 (0.53) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL258422 | 1.00 | ALDH1A1 (0.53) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL2239236 | 1.00 | ALDH1A1 (0.53) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL13050357 | 1.00 | ALDH1A1 (0.53) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL7089968 | 0.98 | ALDH1A1 (0.52) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 | |
| P-Xylene SCHEMBL5424500 | 0.98 | ALDH1A1 (0.52) | ALDH1A1NPSR1SLC1A3SLC1A2SLC1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3106453-A1 | METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND, AND NOVEL METAL-DIAMINE COMPLEX | Takasago International Corporation (JP) | 2016-12-21 | — | — | EP | disclosed |
| EP-2609103-B1 | RUTHENIUM-DIAMINE COMPLEXES AND METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUNDS | TAKASAGO PERFUMERY CO LTD (JP) | 2015-08-19 | — | — | EP | disclosed |
| EP-2703386-A1 | METHOD FOR PRODUCING DIAMINE COMPOUND | Takasago International Corporation (JP) | 2014-03-05 | — | — | EP | disclosed |
| WO-2012026201-A1 | RUTHENIUM-DIAMINE COMPLEXES AND METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUNDS | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2012-03-01 | — | — | WO | disclosed |