Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | F10 | P00742 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4702304 | 1.00 | DPP4 (0.43) | DPP4ALDH1A1CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL6227658 | 1.00 | DPP4 (0.43) | DPP4ALDH1A1CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL24322680 | 0.86 | F10 (0.48) | DPP4CYP3A4CYP2C19KMT2AF10 | |
| Hydrochloric Acid SCHEMBL4705563 | 0.86 | ALDH1A1 (0.40) | DPP4ALDH1A1CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL4704091 | 0.85 | DPP4 (0.40) | DPP4ALDH1A1CYP3A4CYP2C19CYP2C9 | |
| Hydrochloric Acid SCHEMBL4704189 | 0.85 | DPP4 (0.40) | DPP4ALDH1A1CYP3A4CYP2C19CYP2C9 | |
| Hydrochloric Acid SCHEMBL4758841 | 0.85 | DPP4 (0.39) | DPP4ALDH1A1CYP3A4POLBKMT2A | |
| Hydrochloric Acid SCHEMBL4758744 | 0.84 | DPP4 (0.39) | DPP4ALDH1A1POLBKMT2AF10 | |
| SCHEMBL4706597 | 0.84 | DPP4 (0.42) | DPP4ALDH1A1CYP3A4CYP2C19POLB | |
| Hydrochloric Acid SCHEMBL5936109 | 0.84 | DPP4 (0.38) | DPP4ALDH1A1CYP3A4POLBKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1567489-A1 | PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA | GLAXO GROUP LIMITED (GB) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004052851-A1 | PYRROLYDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA | GLAXO GROUP LIMITED (GB) | 2004-06-24 | — | — | WO | disclosed |