Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.46 |
| ▸ | CNR1 | P21554 | 4/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | AKT2 | P31751 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8094067 | 0.89 | PTGS2 (0.49) | PTGS2CNR1CNR2PTGS1 | |
| SCHEMBL8776749 | 0.84 | PTGS2 (0.47) | PTGS2CNR1CNR2RORCALDH1A1 | |
| SCHEMBL8776720 | 0.83 | PTGS2 (0.47) | PTGS2CNR1CNR2KDM4EPTGS1 | |
| SCHEMBL8776822 | 0.80 | PTGS2 (0.56) | PTGS2CNR1CNR2PTGS1SCN9A | |
| SCHEMBL8776765 | 0.77 | CNR1 (0.60) | PTGS2CNR1CNR2KDM4EPTGS1 | |
| SCHEMBL8095119 | 0.76 | HPGD (0.47) | PTGS2KDM4EALDH1A1PTGS1 | |
| SCHEMBL8776719 | 0.76 | PTGS2 (0.44) | PTGS2CNR1CNR2RORCKDM4E | |
| SCHEMBL8099266 | 0.76 | PTGS2 (0.53) | PTGS2ALDH1A1SMN1; SMN2PTGS1 | |
| SCHEMBL8100740 | 0.75 | PTGS2 (0.58) | PTGS2CNR1PTGS1 | |
| SCHEMBL8101771 | 0.75 | PTGS2 (0.54) | PTGS2CNR1CNR2PTGS1 |
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-0808304-A1 | 2,3-SUBSTITUTED PYRIDINES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1997-11-26 | — | — | EP | disclosed |
| WO-1996024584-A1 | 2,3-SUBSTITUTED PYRIDINES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-08-15 | — | — | WO | disclosed |