Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 6/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 7/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | GNA15 | P30679 | 1/20 | 0.36 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
| ▸ | PPARA | Q07869 | 3/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7424973 | 0.86 | MTNR1A (0.40) | SIRT2SIRT1FFAR1CTNNB1AURKA | |
| SCHEMBL5049439 | 0.65 | CTNNB1 (0.59) | SIRT2SIRT1CTNNB1 | |
| SCHEMBL8211650 | 0.65 | CTNNB1 (0.54) | SIRT2SIRT1CTNNB1AURKARPS6KB1 | |
| SCHEMBL27991301 | 0.64 | CTNNB1 (0.57) | SIRT2SIRT1CTNNB1TDP1 | |
| SCHEMBL27872615 | 0.64 | CTNNB1 (0.57) | SIRT2SIRT1CTNNB1 | |
| SCHEMBL27464948 | 0.64 | CTNNB1 (0.53) | SIRT2SIRT1CTNNB1 | |
| SCHEMBL20178657 | 0.63 | EPHX1 (0.47) | SIRT2EPHX1 | |
| SCHEMBL28081509 | 0.63 | BCAT2 (0.61) | SIRT2SIRT1CTNNB1AURKARPS6KB1 | |
| Diphenylether SCHEMBL23068684 | 0.62 | CTNNB1 (0.74) | SIRT2SIRT1CTNNB1 | |
| SCHEMBL9189752 | 0.62 | CTNNB1 (0.62) | SIRT2SIRT1CTNNB1TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1073632-A1 | SUBSTITUTED BENZAMIDES, THEIR PRODUCTION AND THEIR USE AS CYSTEINE PROTEASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-07 | — | — | EP | disclosed |
| WO-1999054293-A1 | SUBSTITUTED BENZAMIDES, THEIR PRODUCTION AND THEIR USE AS CYSTEINE PROTEASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1999-10-28 | — | — | WO | disclosed |