Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 8/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8642065 | 0.88 | PTGS2 (0.62) | PTGS2PTGS1CYP2C9CYP3A4TSHR | |
| SCHEMBL5147701 | 0.85 | PTGS2 (0.71) | PTGS2PTGS1CYP2C9CYP3A4TSHR | |
| SCHEMBL25150243 | 0.84 | PTGS2 (0.72) | PTGS2PTGS1CYP2C9CYP3A4TSHR | |
| SCHEMBL9273738 | 0.84 | PTGS2 (0.72) | PTGS2PTGS1CYP2C9CYP3A4TSHR | |
| SCHEMBL9208582 | 0.83 | PTGS2 (0.74) | PTGS2PTGS1CYP2C9CYP3A4TSHR | |
| SCHEMBL8637148 | 0.83 | PTGS2 (0.73) | PTGS2PTGS1CYP2C9CYP3A4TSHR | |
| SCHEMBL4032238 | 0.83 | PTGS1 (0.74) | PTGS2PTGS1CYP2C9CYP3A4TSHR | |
| SCHEMBL8642061 | 0.82 | PTGS2 (0.67) | PTGS2PTGS1CYP2C9CYP3A4TSHR | |
| SCHEMBL8639953 | 0.82 | PTGS2 (0.48) | PTGS2PTGS1ABCB11 | |
| SCHEMBL27509063 | 0.82 | PTGS2 (0.52) | PTGS2PTGS1CYP2C9CYP3A4TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0856000-A1 | 1,3,5-TRISUBSTITUTED PYRAZOLES FOR TREAMENT OF INFLAMMATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1998-08-05 | — | — | EP | disclosed |
| WO-1997013755-A1 | 1,3,5-TRISUBSTITUTED PYRAZOLES FOR TREAMENT OF INFLAMMATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-04-17 | — | — | WO | disclosed |