Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 10/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 10/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 5/20 | 0.39 |
| ▸ | PPARA | Q07869 | 5/20 | 0.39 |
| ▸ | PPARG | P37231 | 5/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12943159 | 1.00 | ITGB3 (0.43) | ITGB3ITGA2BALDH1A1L3MBTL1PPARD | |
| SCHEMBL8205374 | 0.88 | FFAR1 (0.40) | ITGB3ITGA2BALDH1A1PPARDPPARA | |
| SCHEMBL8209113 | 0.87 | PPARG (0.41) | ITGB3ITGA2BALDH1A1L3MBTL1PPARD | |
| SCHEMBL12907419 | 0.83 | ALDH1A1 (0.42) | ITGB3ITGA2BALDH1A1L3MBTL1PPARD | |
| SCHEMBL12943085 | 0.83 | ITGB3 (0.44) | ITGB3ITGA2BALDH1A1 | |
| SCHEMBL8284973 | 0.79 | PPARG (0.55) | PPARDPPARAPPARG | |
| SCHEMBL8286228 | 0.79 | PPARG (0.55) | PPARDPPARAPPARG | |
| SCHEMBL12943212 | 0.79 | CTSB (0.37) | ITGB3ITGA2BALDH1A1L3MBTL1 | |
| SCHEMBL8211378 | 0.78 | IL1RN (0.47) | — | |
| SCHEMBL25938002 | 0.78 | ITGB3 (0.64) | ITGB3ITGA2BALDH1A1L3MBTL1PPARD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008048121-A2 | MACROCYCLIC CYSTEINE PROTEASE INHIBITORS AND COMPOSITIONS THEREOF | LINCOLN UNIVERSITY (NZ) | 2008-04-24 | — | — | WO | disclosed |