Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8197097 | 0.80 | MAPT (0.48) | MAPTNPC1RAB9AMAPK1MEN1 | |
| SCHEMBL9045665 | 0.79 | TRPM8 (0.64) | MAPTNPC1RAB9AMAPK1MEN1 | |
| SCHEMBL17279907 | 0.78 | RAB9A (0.56) | MAPTNPC1RAB9AMAPK1SMN1; SMN2 | |
| SCHEMBL28977168 | 0.76 | MELK (0.64) | MAPTNPC1RAB9AMAPK1 | |
| SCHEMBL10238578 | 0.75 | MAPT (0.46) | MAPTNPC1RAB9AMAPK1MEN1 | |
| SCHEMBL8202095 | 0.75 | PTGS2 (0.44) | MAPTNPC1RAB9AMAPK1MEN1 | |
| SCHEMBL1662318 | 0.74 | MAPT (0.68) | MAPTNPC1RAB9AMAPK1MEN1 | |
| SCHEMBL8188373 | 0.74 | KDM4E (0.48) | MAPTMAPK1KDM4ECYP3A4NPSR1 | |
| Hydrochloric Acid SCHEMBL8202139 | 0.74 | MAPT (0.44) | MAPTNPC1RAB9AMAPK1MEN1 | |
| SCHEMBL8490480 | 0.74 | AXL (0.64) | MAPTNPC1RAB9AMAPK1MEN1 |
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 |