Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 6/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.42 |
| ▸ | DPP8 | Q6V1X1 | 4/20 | 0.40 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.40 |
| ▸ | MARS1 | P56192 | 2/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3102939 | 0.89 | DPP4 (0.47) | DPP4CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL3604955 | 0.85 | DPP4 (0.48) | DPP4CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL3092513 | 0.84 | DPP4 (0.47) | DPP4CYP3A4DPP8 | |
| SCHEMBL3595829 | 0.83 | CYP3A4 (0.44) | DPP4CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL3096850 | 0.82 | DPP4 (0.44) | DPP4CYP3A4DPP8 | |
| SCHEMBL3600802 | 0.82 | DPP4 (0.44) | DPP4DPP8 | |
| SCHEMBL3586864 | 0.82 | DPP4 (0.45) | DPP4CYP3A4DPP8 | |
| SCHEMBL3604409 | 0.81 | DPP4 (0.45) | DPP4CYP3A4DPP8 | |
| SCHEMBL3585733 | 0.81 | DPP4 (0.46) | DPP4CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL3583003 | 0.81 | DPP4 (0.42) | DPP4CYP3A4DPP8DPP9MARS1 |
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-7728146-B2 | Enzyme inhibitors | PROBIODRUG AG (DE) | 2010-06-01 | — | — | US | claimed |