Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL27946122 | 0.82 | DPP4 (0.47) | DPP4ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL27669214 | 0.81 | GPR84 (0.41) | DPP4ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL3678678 | 0.80 | TSHR (0.44) | ALDH1A1CYP2A6TSHR | |
| SCHEMBL8679017 | 0.79 | ADORA3 (0.41) | DPP4ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL5551237 | 0.78 | TSHR (0.55) | DPP4ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL26307961 | 0.77 | CA12 (0.46) | DPP4ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL1254511 | 0.77 | CA12 (0.46) | DPP4ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL24017102 | 0.76 | ALDH1A1 (0.48) | DPP4ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL7047063 | 0.76 | ALDH1A1 (0.48) | DPP4ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL24017101 | 0.76 | ALDH1A1 (0.48) | DPP4ALDH1A1HSD17B10CA12CA1 |
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-0363223-A2 | 3-Aryloxymethyl-cephalosporin derivatives, their preparation and their medical use | Sankyo Company Limited (JP) | 1990-04-11 | — | — | EP | disclosed |