Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 20/20 | 0.50 |
| ▸ | POU2F2 | P09086 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | POU2F1 | P14859 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | HRH2 | P25021 | 1/20 | 0.48 |
| ▸ | MC4R | P32245 | 1/20 | 0.48 |
| ▸ | FAP | Q12884 | 1/20 | 0.48 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.48 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.48 |
| ▸ | GHSR | Q92847 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13945566 | 0.95 | DPP4 (0.49) | DPP4POU2F2ADORA3CHRM1POU2F1 | |
| SCHEMBL8270386 | 0.91 | DPP4 (0.62) | DPP4POU2F2ADORA3CHRM1POU2F1 | |
| SCHEMBL8269360 | 0.88 | DPP4 (0.52) | DPP4POU2F2ADORA3CHRM1POU2F1 | |
| SCHEMBL8270387 | 0.87 | DPP4 (0.60) | DPP4POU2F2ADORA3CHRM1POU2F1 | |
| SCHEMBL8271383 | 0.87 | DPP4 (0.64) | DPP4POU2F2ADORA3CHRM1POU2F1 | |
| SCHEMBL8270377 | 0.87 | DPP4 (0.66) | DPP4CYP3A4 | |
| SCHEMBL8268761 | 0.86 | DPP4 (0.52) | DPP4POU2F2ADORA3CHRM1POU2F1 | |
| SCHEMBL13945305 | 0.84 | DPP4 (0.62) | DPP4CHRM1 | |
| SCHEMBL8270398 | 0.84 | DPP4 (0.52) | DPP4POU2F2ADORA3CHRM1POU2F1 | |
| SCHEMBL8270392 | 0.83 | DPP4 (0.53) | DPP4POU2F2ADORA3CHRM1POU2F1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7495003-B2 | 8-(3-amino-piperidin-1-yl)-7-(but-2-ynyl)-xanthines, the preparation thereof and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-02-24 | — | — | US | disclosed |