Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2D | O15399 | 1/20 | 0.46 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.46 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3135465 | 0.80 | LCK (0.34) | ALDH1A1CA12CA9ALOX5KDM4E | |
| Water SCHEMBL8972205 | 0.79 | GRIN2D (0.63) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| Water SCHEMBL8972153 | 0.79 | GRIN2D (0.63) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL27609031 | 0.78 | ACMSD (0.55) | GRIN2DGRIN2AGRIN2BGRIN2CACMSD | |
| Water SCHEMBL9497897 | 0.77 | GRIN2D (0.61) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| Water SCHEMBL9498597 | 0.77 | GRIN2D (0.61) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL29358330 | 0.77 | GRIN2D (0.66) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL6460 | 0.77 | GRIN2D (0.66) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL5353853 | 0.76 | GRIN2D (0.57) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL5369132 | 0.76 | GRIN2D (0.57) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1558762-A | Novel ligands for the HisB10 Zn2+ sites of the R-state insulin hexamer | ŵ��Ų�ڿ˹�˾ | 2004-12-29 | — | — | CN | disclosed |
| EP-0482789-B1 | Benzoquinone compounds | ZENECA LTD (GB) | 1996-01-03 | — | — | EP | disclosed |
| US-5283355-A | Benzoquinone compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-02-01 | — | — | US | disclosed |
| EP-0482789-A2 | Benzoquinone compounds | ZENECA LIMITED (GB) | 1992-04-29 | — | — | EP | disclosed |