Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | XBP1 | P17861 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.48 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19709656 | 0.88 | ALDH1A1 (0.47) | L3MBTL1CNR1CNR2AURKAPDK1 | |
| SCHEMBL18302940 | 0.75 | SMN1; SMN2 (0.64) | L3MBTL1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL19692380 | 0.72 | CNR1 (0.51) | L3MBTL1CNR1CNR2AURKAPDK1 | |
| SCHEMBL5508929 | 0.71 | CNR2 (0.52) | L3MBTL1CNR1CNR2PTGS1PTGS2 | |
| SCHEMBL13534157 | 0.70 | L3MBTL1 (0.44) | L3MBTL1PTGS1PTGS2PTGDR2ALDH1A1 | |
| SCHEMBL1845730 | 0.70 | PDPK1 (0.50) | — | |
| SCHEMBL11607355 | 0.69 | PKM (0.51) | LMNAL3MBTL1ALDH1A1KDM4EMEN1 | |
| SCHEMBL5516297 | 0.69 | CNR2 (0.54) | CNR1CNR2PTGS1PTGS2PTGDR2 | |
| SCHEMBL11922698 | 0.69 | CNR2 (0.54) | CNR1CNR2PDK1PTGS1PTGS2 | |
| SCHEMBL13534311 | 0.69 | TP53 (0.45) | LMNAP2RX3ALDH1A1KDM4EMEN1 |
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-3468556-A1 | 2-OXO-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE COMPOUNDS AND THEIR USE AS DUAL INHIBITORS OF PDK1/AURA | International Society for Drug Development S.r.l. (IT) | 2019-04-17 | — | — | EP | disclosed |
| WO-2017211946-A1 | 2-OXO-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE COMPOUNDS AND THEIR USE AS DUAL INHIBITORS OF PDK1/AURA | INTERNATIONAL SOCIETY FOR DRUG DEVELOPMENT S.R.L. (IT) | 2017-12-14 | — | — | WO | disclosed |