Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 4/20 | 0.43 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 8/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177558 | 0.84 | GRM2 (0.45) | DPP4DPP7GRM2MAPTALDH1A1 | |
| SCHEMBL20177639 | 0.79 | GRM2 (0.44) | DPP4DPP7GRM2MAPTALDH1A1 | |
| SCHEMBL20177496 | 0.79 | GRM2 (0.44) | DPP4DPP7GRM2MAPTALDH1A1 | |
| SCHEMBL20177640 | 0.72 | DPP4 (0.38) | DPP4DPP7ALDH1A1KDM4ETP53 | |
| SCHEMBL13342393 | 0.68 | DPP4 (0.82) | DPP4DPP7CYP2D6 | |
| SCHEMBL20177525 | 0.66 | ADRA1A (0.56) | — | |
| SCHEMBL20177859 | 0.66 | ADRA1A (0.31) | — | |
| SCHEMBL20177638 | 0.66 | ADRA1A (0.56) | — | |
| SCHEMBL7924287 | 0.62 | DPP4 (0.38) | DPP4DPP7GRM2ALDH1A1 | |
| SCHEMBL20177902 | 0.61 | GRM4 (0.39) | — |
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-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |