Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STK17B | O94768 | 1/20 | 0.42 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.42 |
| ▸ | MAPKAPK2 | P49137 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6058971 | 0.88 | STK17B (0.41) | STK17BSTK17AMAPKAPK2ALDH1A1ATR | |
| SCHEMBL13428494 | 0.84 | STK17B (0.54) | STK17BSTK17AALDH1A1L3MBTL1TDP1 | |
| SCHEMBL6059338 | 0.83 | LCK (0.40) | STK17BSTK17AMAPKAPK2LCKATR | |
| SCHEMBL6059446 | 0.81 | CPB2 (0.41) | STK17BSTK17AMAPKAPK2ALDH1A1L3MBTL1 | |
| SCHEMBL9646590 | 0.80 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1TDP1MEN1KMT2A | |
| SCHEMBL14822488 | 0.80 | ATR (0.40) | STK17BSTK17AMAPKAPK2ALDH1A1ATR | |
| SCHEMBL6060000 | 0.79 | CPB2 (0.39) | STK17BSTK17AMAPKAPK2ALDH1A1L3MBTL1 | |
| SCHEMBL6059420 | 0.79 | L3MBTL1 (0.38) | STK17BSTK17AMAPKAPK2ALDH1A1ATR | |
| SCHEMBL7382657 | 0.78 | NR4A1 (0.39) | STK17BSTK17AMAPKAPK2ALDH1A1ATR | |
| Malonic Acid Diethyl Ester SCHEMBL7380709 | 0.78 | L3MBTL1 (0.41) | STK17BSTK17AMAPKAPK2ALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7071175-B1 | Pyridine mercapto carboxylic acids as carboxypeptidase U inhibitors | ASTRAZENECA AB (SE) | 2006-07-04 | — | — | US | disclosed |
| EP-1180098-A1 | NEW COMPOUNDS | AstraZeneca AB (SE) | 2002-02-20 | — | — | EP | disclosed |
| WO-2000066557-A1 | NEW COMPOUNDS | ASTRAZENECA AB (SE) | 2000-11-09 | — | — | WO | disclosed |