Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 15/20 | 0.40 |
| ▸ | NMBR | P28336 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10978566 | 0.88 | SIRT2 (0.48) | SIRT2NMBR | |
| SCHEMBL6943555 | 0.82 | SIRT2 (0.49) | SIRT2NMBRCYP11B1CYP11B2ENPP2 | |
| SCHEMBL10976975 | 0.80 | SIRT2 (0.43) | SIRT2NMBRCYP11B1CYP11B2ENPP2 | |
| SCHEMBL2002061 | 0.79 | SIRT2 (0.45) | SIRT2NMBRCYP11B1CYP11B2HIF1A | |
| SCHEMBL31370665 | 0.76 | SIRT2 (0.48) | SIRT2NMBRENPP2 | |
| SCHEMBL877052 | 0.76 | SIRT2 (0.46) | SIRT2NMBRCYP11B1CYP11B2ENPP2 | |
| SCHEMBL10187011 | 0.74 | SIRT2 (0.46) | SIRT2NMBRCYP11B1CYP11B2ENPP2 | |
| SCHEMBL30547297 | 0.74 | SIRT2 (0.45) | SIRT2NMBRCYP11B1CYP11B2 | |
| SCHEMBL2180673 | 0.73 | SIRT2 (0.45) | SIRT2NMBRCYP11B1CYP11B2ENPP2 | |
| SCHEMBL1924923 | 0.73 | SIRT2 (0.45) | SIRT2NMBRCYP11B1CYP11B2ENPP2 |
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-0046290-A1 | Synergistic combination of (R,S)alpha-fluoromethylhistidine and cimetidine as an anti-ulcer agent | MERCK & CO. INC. (US) | 1982-02-24 | — | — | EP | disclosed |