Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | FNTA | P49354 | 1/20 | 0.36 |
| ▸ | FNTB | P49356 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CPN1 | P15169 | 1/20 | 0.33 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15774971 | 0.86 | ITGB3 (0.39) | ALDH1A1MAPK1ITGB3ITGA2BLMNA | |
| SCHEMBL14813701 | 0.82 | ALDH1A1 (0.43) | ALDH1A1MAPK1ITGB3ITGA2BLMNA | |
| SCHEMBL13548205 | 0.80 | EPHX2 (0.47) | ALDH1A1POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1011679 | 0.80 | ITGB3 (0.40) | ALDH1A1MAPK1ITGB3ITGA2BLMNA | |
| SCHEMBL28786378 | 0.80 | ITGB3 (0.40) | ALDH1A1MAPK1ITGB3ITGA2BLMNA | |
| SCHEMBL24449560 | 0.79 | ALDH1A1 (0.38) | ALDH1A1MAPK1ITGB3ITGA2BLMNA | |
| SCHEMBL14813742 | 0.79 | LMNA (0.43) | ALDH1A1MAPK1ITGB3ITGA2BLMNA | |
| SCHEMBL29889243 | 0.78 | ALDH1A1 (0.39) | ALDH1A1MAPK1LMNAPOLBEPHX2 | |
| SCHEMBL1009375 | 0.77 | ITGB3 (0.41) | ALDH1A1MAPK1ITGB3ITGA2BLMNA | |
| SCHEMBL15774600 | 0.74 | LTA4H (0.37) | ALDH1A1NPC1 |
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-1732920-A2 | THIOPHENE DERIVATIVES AS CHK 1 INHIBITORS | AstraZeneca AB (SE) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005066163-A2 | THIOPHENE DERIVATIVES AS CHK 1 INIHIBITORS | ASTRAZENECA AB (SE) | 2005-07-21 | — | — | WO | disclosed |