Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.42 |
| ▸ | PPARG | P37231 | 6/20 | 0.40 |
| ▸ | PPARA | Q07869 | 5/20 | 0.40 |
| ▸ | MGLL | Q99685 | 2/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.38 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.38 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | CYP24A1 | Q07973 | 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 | |
|---|---|---|---|---|
| SCHEMBL5761043 | 1.00 | ERBB2 (0.49) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5761048 | 1.00 | ERBB2 (0.49) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5757306 | 1.00 | ERBB2 (0.49) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5762604 | 0.99 | ERBB2 (0.49) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5757663 | 0.99 | ERBB2 (0.49) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5762454 | 0.97 | ERBB2 (0.47) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5762449 | 0.97 | ERBB2 (0.47) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5760720 | 0.93 | ERBB2 (0.45) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5760715 | 0.93 | ERBB2 (0.45) | ERBB2MINK1FFAR1PPARGPPARA | |
| SCHEMBL5758328 | 0.87 | PPARA (0.40) | ERBB2MINK1PPARGPPARAMGLL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1270571-B1 | Heterocyclic compounds, their production and use | TAKEDA PHARMACEUTICAL (JP) | 2006-09-06 | — | — | EP | disclosed |
| EP-1270571-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-01-02 | — | — | EP | disclosed |
| US-6211215-B1 | AROMATIC HETEROCYCLIC COMPOUND WITH AZOLE COMPOUND | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-04-03 | — | — | US | disclosed |