Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.33 |
| ▸ | USP7 | Q93009 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8196871 | 0.82 | GRM5 (0.41) | GRM5PTPN11DYRK1ADYRK1BALDH1A1 | |
| SCHEMBL8187634 | 0.78 | GRM5 (0.38) | GRM5PTPN11ALDH1A1MAPTMAPK1 | |
| SCHEMBL8195771 | 0.76 | GRM5 (0.37) | GRM5PTPN11DYRK1ADYRK1BALDH1A1 | |
| SCHEMBL8641978 | 0.73 | ERBB2 (0.35) | DYRK1A | |
| SCHEMBL8194882 | 0.72 | PTGS2 (0.38) | KDM4E | |
| SCHEMBL3653300 | 0.69 | MAPK14 (0.54) | DYRK1AALDH1A1KDM4EMAPK1 | |
| SCHEMBL8197268 | 0.68 | DYRK1A (0.43) | GRM5DYRK1AALDH1A1HPGDHSD17B10 | |
| SCHEMBL8194840 | 0.65 | MAPT (0.37) | ALDH1A1HPGDMAPTLMNAMAPK1 | |
| SCHEMBL8197097 | 0.64 | MAPT (0.48) | ALDH1A1KDM4EMAPTLMNAMAPK1 | |
| SCHEMBL27400535 | 0.64 | NPC1 (0.36) | DYRK1AALDH1A1MAPTCHEK1MAPK1 |
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-2000018741-A2 | PYRAZOLE COMPOUNDS AS COX-2 INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-04-06 | — | — | WO | disclosed |