Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PHGDH | O43175 | 1/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9737802 | 0.77 | — | — | |
| SCHEMBL7068168 | 0.71 | — | — | |
| SCHEMBL11175493 | 0.69 | — | — | |
| SCHEMBL11033622 | 0.69 | ALDH1A1 (0.44) | ALDH1A1PTGS2HSD17B10PHGDH | |
| SCHEMBL2321194 | 0.68 | HTT (0.41) | ALDH1A1HSD17B10MGLL | |
| Hydrazine SCHEMBL11634157 | 0.67 | ALDH1A1 (0.41) | ALDH1A1PTGS2HSD17B10 | |
| SCHEMBL6210141 | 0.65 | CA12 (0.55) | — | |
| SCHEMBL28293833 | 0.65 | — | — | |
| SCHEMBL11033624 | 0.65 | — | — | |
| SCHEMBL28797073 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0403524-B1 | PREPARATION OF NITRURO COMPOUNDS USABLE AS RADIO-PHARMACEUTICAL PRODUCTS | CIS BIO INTERNATIONAL (FR) | 1993-02-10 | — | — | EP | claimed |