Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 11/20 | 0.61 |
| ▸ | PLK1 | P53350 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NCEH1 | Q6PIU2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16267030 | 0.89 | GAA (0.48) | SIGMAR1PLK1ALDH1A1PGRGAA | |
| SCHEMBL11543045 | 0.81 | PLK1 (0.49) | SIGMAR1PLK1ALDH1A1PGRGAA | |
| SCHEMBL24930138 | 0.81 | SIGMAR1 (0.39) | SIGMAR1PLK1ALDH1A1PGRGAA | |
| SCHEMBL9438357 | 0.81 | SIGMAR1 (0.68) | SIGMAR1PLK1ALDH1A1PGRGAA | |
| SCHEMBL1614544 | 0.80 | SIGMAR1 (0.67) | SIGMAR1PLK1GAASLC6A2SLC6A4 | |
| SCHEMBL29666490 | 0.80 | SIGMAR1 (0.67) | SIGMAR1PLK1GAASLC6A2SLC6A4 | |
| SCHEMBL3626830 | 0.80 | SIGMAR1 (0.67) | SIGMAR1ALDH1A1GAANPC1RAB9A | |
| SCHEMBL2090835 | 0.79 | SIGMAR1 (0.61) | SIGMAR1ALDH1A1PGRGAAPTGS1 | |
| SCHEMBL10492074 | 0.79 | SIGMAR1 (0.57) | SIGMAR1PLK1ALDH1A1PGRGAA | |
| SCHEMBL11872011 | 0.79 | SIGMAR1 (0.65) | SIGMAR1PLK1GAANCEH1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107266338-B | The manufacturing method of isocyanates | 旭化成株式会社 | 2019-10-11 | — | — | CN | disclosed |
| CN-105026367-B | Method for producing isothiocyanate | 旭化成株式会社 | 2019-05-21 | — | — | CN | disclosed |
| CN-108976155-A | The manufacturing method of isothiocyanates | 旭化成株式会社 | 2018-12-11 | — | — | CN | disclosed |
| CN-105102422-B | Method for producing isocyanate | 旭化成株式会社 | 2018-01-09 | — | — | CN | disclosed |
| CN-107266338-A | The manufacture method of isocyanates | 旭化成株式会社 | 2017-10-20 | — | — | CN | disclosed |