Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.31 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.31 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | IDH1 | O75874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25160909 | 1.00 | PTGS2 (0.35) | PTGS2KDM4EALDH1A1DPP8DPP9 | |
| SCHEMBL25160763 | 0.83 | SMN1; SMN2 (0.37) | PTGS2KDM4EALDH1A1GAA | |
| SCHEMBL19066704 | 0.83 | PTGS2 (0.34) | PTGS2ALDH1A1DPP8DPP9DPP7 | |
| SCHEMBL30269822 | 0.77 | TSHR (0.38) | PTGS2KDM4EALDH1A1GLAGAA | |
| SCHEMBL1106467 | 0.75 | KDM4E (0.39) | PTGS2KDM4EALDH1A1CA2 | |
| SCHEMBL21459733 | 0.74 | PTGS2 (0.41) | PTGS2KDM4EDPP8DPP9DPP7 | |
| SCHEMBL21459771 | 0.74 | PTGS2 (0.41) | PTGS2KDM4EDPP8DPP9DPP7 | |
| SCHEMBL21459731 | 0.74 | PTGS2 (0.41) | PTGS2KDM4EDPP8DPP9DPP7 | |
| SCHEMBL21459515 | 0.71 | KDM4E (0.39) | PTGS2KDM4EALDH1A1GLAGAA | |
| SCHEMBL25160271 | 0.70 | MAPT (0.48) | KDM4EALDH1A1HPGD |
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-3397629-B1 | METALLOENZYME INHIBITOR COMPOUNDS | NQP 1598 LTD (KY) | 2023-04-19 | — | — | EP | disclosed |