Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 17/20 | 0.71 |
| ▸ | DPP7 | Q9UHL4 | 10/20 | 0.71 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.71 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.71 |
| ▸ | DPP9 | Q86TI2 | 9/20 | 0.56 |
| ▸ | DPP8 | Q6V1X1 | 8/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL1240926 | 0.83 | DPP4 (1.00) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL8261870 | 0.82 | DPP4 (0.84) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL12891144 | 0.82 | DPP4 (0.84) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL5114076 | 0.81 | DPP4 (0.71) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL1242439 | 0.77 | DPP4 (0.49) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL1242422 | 0.75 | DPP4 (0.55) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL2937242 | 0.74 | DPP4 (0.48) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL1241000 | 0.73 | DPP4 (0.47) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL1240995 | 0.73 | DPP4 (0.47) | DPP4DPP7CYP2D6KCNH2DPP9 | |
| SCHEMBL8261904 | 0.69 | DPP4 (0.88) | DPP4DPP7CYP2D6KCNH2DPP9 |
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-7884104-B2 | Such as (3R,4R)-1-Pyrimidin-4-yl-4-(2,4,5-trifluorophenyl)piperidin-3-amine bis-trifluoroacetic acid salt | MERCK SHARP & DOHME CORP. (US) | 2011-02-08 | — | — | US | disclosed |