Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 15/20 | 0.63 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.41 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.41 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.40 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.40 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4675467 | 1.00 | DPP4 (0.63) | DPP4MCHR1ESR1ESR2DPP8 | |
| Hydrochloric Acid SCHEMBL3895933 | 0.89 | DPP4 (0.76) | DPP4DPP8DPP9 | |
| Hydrochloric Acid SCHEMBL3895926 | 0.89 | DPP4 (0.76) | DPP4DPP8DPP9 | |
| SCHEMBL3890646 | 0.88 | DPP4 (0.81) | DPP4 | |
| SCHEMBL3890650 | 0.88 | DPP4 (0.81) | DPP4 | |
| SCHEMBL3890623 | 0.87 | DPP4 (0.61) | DPP4ESR1ESR2IP6K1IP6K3 | |
| SCHEMBL3890616 | 0.87 | DPP4 (0.61) | DPP4ESR1ESR2IP6K1IP6K3 | |
| SCHEMBL3895296 | 0.83 | DPP4 (0.48) | DPP4MCHR1ESR1ESR2DPP8 | |
| SCHEMBL3895305 | 0.83 | DPP4 (0.48) | DPP4MCHR1ESR1ESR2DPP8 | |
| SCHEMBL3892568 | 0.82 | DPP4 (0.45) | DPP4ESR1ESR2DPP8DPP9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1527049-B1 | FUSED HETEROCYCLIC COMPOUNDS AS PEPTIDASE INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2008-07-16 | — | — | EP | disclosed |