Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 7/20 | 0.67 |
| ▸ | BCHE | P06276 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.59 |
| ▸ | ALDH3A1 | P30838 | 5/20 | 0.59 |
| ▸ | ALDH2 | P05091 | 4/20 | 0.59 |
| ▸ | CDC25A | P30304 | 1/20 | 0.57 |
| ▸ | TGM2 | P21980 | 1/20 | 0.57 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.50 |
| ▸ | TTR | P02766 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL281962 | 0.91 | ALDH1A1 (0.64) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL578329 | 0.87 | CES1 (0.71) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL5428316 | 0.83 | CES1 (0.65) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL4309242 | 0.82 | ALDH1A1 (0.59) | ALDH1A1MAOB | |
| SCHEMBL19924204 | 0.81 | CES1 (1.00) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL3016508 | 0.78 | CES1 (0.79) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL10685462 | 0.78 | CES1 (1.00) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL10682318 | 0.78 | CES1 (0.67) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL25119569 | 0.78 | CES1 (0.85) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL10681723 | 0.77 | CES1 (0.65) | CES1BCHEALDH1A1ALDH3A1ALDH2 |
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-4382934-A | ANTIALLERGENS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1983-05-10 | — | — | US | disclosed |
| EP-0010398-B1 | ISATIN DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1983-04-27 | — | — | EP | disclosed |
| EP-0010398-A1 | Isatin derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1980-04-30 | — | — | EP | disclosed |