Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 17/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 17/20 | 0.43 |
| ▸ | F2R | P25116 | 6/20 | 0.43 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.33 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.33 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9344311 | 0.87 | ITGB3 (0.36) | ITGB3ITGA2BF2RGNAI3GNAO1 | |
| Glycine SCHEMBL9349017 | 0.81 | ITGB3 (0.37) | ITGB3ITGA2BF2R | |
| SCHEMBL8259490 | 0.81 | MMP2 (0.38) | ITGB3ITGA2B | |
| Isonipecotic Acid SCHEMBL9344171 | 0.79 | GABRA5 (0.50) | ITGB3ITGA2B | |
| SCHEMBL9348784 | 0.79 | ITGB3 (0.34) | ITGB3ITGA2BF2R | |
| Fumaric Acid SCHEMBL9348760 | 0.78 | ITGB3 (0.37) | ITGB3ITGA2BF2R | |
| Fumaric Acid SCHEMBL9348754 | 0.78 | ITGB3 (0.37) | ITGB3ITGA2BF2R | |
| Alanine SCHEMBL9344287 | 0.78 | ITGB3 (0.36) | ITGB3ITGA2BGNAI3GNAO1GNAI1 | |
| Fumaric Acid SCHEMBL9346349 | 0.78 | ITGB3 (0.35) | ITGB3ITGA2BF2R | |
| Fumaric Acid SCHEMBL9346367 | 0.78 | ITGB3 (0.35) | ITGB3ITGA2BF2R |
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 |
|---|---|---|---|---|---|---|---|
| US-5280031-A | Cyclic azaaliphatic compounds with a nitroxy function, processes for the preparation thereof and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1994-01-18 | — | — | US | disclosed |
| US-5030641-A | Treatment of angina pectoris, hypotensive agents | BOEHRINGER MANNHEIM GMBH (DE) | 1991-07-09 | — | — | US | disclosed |