Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.40 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | LSS | P48449 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3392726 | 0.85 | ALDH1A1 (0.50) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| SCHEMBL5535869 | 0.77 | PPARG (0.48) | ALDH1A1MEN1KMT2APPARGPPARA | |
| SCHEMBL5547325 | 0.76 | PPARG (0.42) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| SCHEMBL20582537 | 0.76 | PPARG (0.45) | ALDH1A1TSHRMEN1KMT2APPARG | |
| SCHEMBL5542216 | 0.75 | PPARG (0.47) | ALDH1A1TSHRMEN1KMT2APPARG | |
| SCHEMBL3397349 | 0.74 | ALDH1A1 (0.52) | ALDH1A1TSHRMEN1KMT2ALMNA | |
| SCHEMBL14438052 | 0.74 | PPARG (0.51) | ALDH1A1TSHRMEN1KMT2APPARG | |
| SCHEMBL13070096 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL3392212 | 0.73 | ALDH1A1 (0.41) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| SCHEMBL5535410 | 0.72 | SIGMAR1 (0.46) | ALDH1A1MEN1KMT2APPARGPPARA |
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-2246329-A1 | 4(1H)-pyridinone derivatives and their use as antimalaria agents | Glaxo Group Limited (GB) | 2010-11-03 | — | — | EP | disclosed |
| EP-2246329-A1 | 4(1H)-pyridinone derivatives and their use as antimalaria agents | Glaxo Group Limited (GB) | 2010-11-03 | — | — | EP | disclosed |
| WO-2010081904-A1 | 4 ( 1H) -PYRIDINONE DERIVATIVES AND THEIR USE AS ANTIMALARIA AGENTS | GLAXO GROUP LIMITED (GB) | 2010-07-22 | — | — | WO | disclosed |