Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 20/20 | 0.63 |
| ▸ | FAP | Q12884 | 3/20 | 0.48 |
| ▸ | 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 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.48 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.48 |
| ▸ | GHSR | Q92847 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12047555 | 0.91 | DPP4 (0.75) | DPP4FAPPOU2F2ADORA3CHRM1 | |
| SCHEMBL8216730 | 0.87 | DPP4 (0.63) | DPP4FAPPOU2F2ADORA3CHRM1 | |
| SCHEMBL8215317 | 0.86 | DPP4 (0.48) | DPP4FAPPOU2F2ADORA3CHRM1 | |
| SCHEMBL11910975 | 0.85 | DPP4 (0.83) | DPP4FAPPOU2F2ADORA3CHRM1 | |
| SCHEMBL8206959 | 0.84 | DPP4 (0.54) | DPP4CYP3A4CYP1A2CYP2D6KCNH2 | |
| SCHEMBL8213377 | 0.84 | DPP4 (0.63) | DPP4FAPPOU2F2ADORA3CHRM1 | |
| SCHEMBL8207278 | 0.83 | DPP4 (0.62) | DPP4FAPPOU2F2ADORA3CHRM1 | |
| SCHEMBL8215322 | 0.83 | DPP4 (0.49) | DPP4FAPPOU2F2ADORA3CHRM1 | |
| SCHEMBL8214899 | 0.82 | DPP4 (0.51) | DPP4DPP9CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL8215042 | 0.82 | DPP4 (0.61) | DPP4FAPPOU2F2ADORA3CHRM1 |
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-2008017670-A1 | PYRROLO [3, 2 -D] PYRIMIDINES AS DPP-IV INHIBITORS FOR THE TREATMENT OF DIABETES MELLITUS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-02-14 | — | — | WO | disclosed |