Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | FASN | P49327 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 4/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL13450126 | 0.84 | IMPDH2 (0.41) | CYP3A4MEN1KMT2ARXFP1FASN | |
| SCHEMBL16166121 | 0.83 | ABCB1 (0.46) | CYP3A4FASNERN1ABCB1TDP1 | |
| SCHEMBL8699353 | 0.76 | ERN1 (0.47) | MEN1KMT2ARXFP1ERN1IMPDH2 | |
| SCHEMBL8571840 | 0.74 | FASN (0.48) | CYP3A4MEN1KMT2ARXFP1FASN | |
| SCHEMBL743276 | 0.72 | ERN1 (0.57) | CYP3A4KMT2AERN1 | |
| SCHEMBL29694978 | 0.72 | ERN1 (0.47) | CYP3A4ERN1ALDH1A1 | |
| SCHEMBL4054977 | 0.72 | MAPT (0.51) | CYP3A4KMT2AERN1KDM4E | |
| SCHEMBL14262143 | 0.71 | TNKS2 (0.47) | CYP3A4ERN1ALDH1A1 | |
| SCHEMBL15266045 | 0.71 | ALOX5 (0.44) | ERN1IMPDH2 | |
| SCHEMBL21626905 | 0.71 | ALDH1A1 (0.41) | CYP3A4MEN1KMT2ARXFP1KDM4E |
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-0415566-A1 | Heterocyclic compounds, processes for producing them and pharmaceutical compositions comprising them | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1991-03-06 | — | — | EP | disclosed |