Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 11/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.53 |
| ▸ | HPGD | P15428 | 5/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 9/20 | 0.50 |
| ▸ | NPC1 | O15118 | 9/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.50 |
| ▸ | RELA | Q04206 | 3/20 | 0.50 |
| ▸ | HBB | P68871 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8086508 | 0.93 | PTGS2 (0.60) | ALDH1A1LMNAKDM4EL3MBTL1HTT | |
| SCHEMBL8520426 | 0.87 | ALDH1A1 (0.52) | ALDH1A1LMNAKDM4EL3MBTL1HTT | |
| SCHEMBL8776744 | 0.85 | SQOR (0.46) | KDM4EL3MBTL1HTTNPSR1MAPT | |
| SCHEMBL8092670 | 0.83 | GLA (0.44) | ALDH1A1LMNAKDM4EL3MBTL1HTT | |
| SCHEMBL8093490 | 0.83 | ALDH1A1 (0.51) | ALDH1A1LMNANPSR1MAPTRAB9A | |
| SCHEMBL8104361 | 0.81 | ALDH1A1 (0.46) | ALDH1A1LMNAKDM4EHPGDPTGS2 | |
| SCHEMBL8094384 | 0.81 | MAPK13 (0.47) | ALDH1A1LMNAPTGS2RAB9A | |
| SCHEMBL8093245 | 0.79 | ALDH1A1 (0.45) | ALDH1A1LMNAKDM4EL3MBTL1HPGD | |
| SCHEMBL8094551 | 0.79 | CNR1 (0.49) | L3MBTL1NPSR1PTGS2MEN1KMT2A | |
| SCHEMBL8520425 | 0.78 | ALDH1A1 (0.50) | ALDH1A1LMNAKDM4EL3MBTL1HTT |
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 |