Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 7/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HBB | P68871 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8092688 | 0.91 | MAPK13 (0.43) | PDE10ATSHRTP53MAPTHPGD | |
| SCHEMBL8519904 | 0.89 | TSHR (0.41) | PDE10ATSHRTP53MAPTHPGD | |
| SCHEMBL8094384 | 0.84 | MAPK13 (0.47) | LMNAALDH1A1PTGS2PTGS1CA12 | |
| SCHEMBL8086490 | 0.80 | ALDH1A1 (0.42) | LMNAALDH1A1PTGS2PTGS1CA12 | |
| SCHEMBL8519903 | 0.80 | MAPT (0.41) | PDE10ATSHRTP53MAPTHPGD | |
| SCHEMBL8095193 | 0.80 | CNR1 (0.46) | LMNAALDH1A1PTGS2PTGS1CA12 | |
| SCHEMBL8086039 | 0.80 | TSHR (0.50) | TSHRMAPTHPGDALOX15SMN1; SMN2 | |
| SCHEMBL8104361 | 0.79 | ALDH1A1 (0.46) | HPGDLMNAALDH1A1PTGS2PTGS1 | |
| SCHEMBL8093245 | 0.79 | ALDH1A1 (0.45) | TSHRHPGDLMNAALDH1A1PTGS2 | |
| SCHEMBL8095485 | 0.79 | ALDH1A1 (0.44) | LMNAALDH1A1PTGS2PTGS1CA12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0808304-B1 | 2,3-SUBSTITUTED PYRIDINES FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 2000-12-27 | — | — | EP | disclosed |
| 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 |