Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | DPP4 | P27487 | 17/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | POU2F2 | P09086 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | POU2F1 | P14859 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | HRH2 | P25021 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.43 |
| ▸ | FAP | Q12884 | 1/20 | 0.43 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.43 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.43 |
| ▸ | GHSR | Q92847 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13945337 | 0.94 | DPP4 (0.50) | DPP4CHRM1 | |
| SCHEMBL8270403 | 0.92 | DPP4 (0.59) | DPP4CHRM1POU2F2ADORA3POU2F1 | |
| SCHEMBL8271382 | 0.92 | DPP4 (0.52) | ALDH1A1LMNATSHRNPSR1DPP4 | |
| SCHEMBL13944303 | 0.90 | ALDH1A1 (0.49) | ALDH1A1LMNATSHRNPSR1DPP4 | |
| SCHEMBL8270429 | 0.86 | DPP4 (0.49) | ALDH1A1LMNATSHRNPSR1DPP4 | |
| SCHEMBL8270402 | 0.86 | DPP4 (0.53) | ALDH1A1LMNATSHRNPSR1DPP4 | |
| SCHEMBL8270395 | 0.86 | DPP4 (0.62) | DPP4CHRM1 | |
| SCHEMBL8270632 | 0.85 | DPP4 (0.51) | ALDH1A1LMNATSHRNPSR1DPP4 | |
| SCHEMBL8271381 | 0.85 | DPP4 (0.51) | DPP4CHRM1 | |
| SCHEMBL13945342 | 0.85 | DPP4 (0.48) | ALDH1A1LMNATSHRNPSR1DPP4 |
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 |