Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA4 | P22748 | 1/20 | 0.54 |
| ▸ | CA6 | P23280 | 1/20 | 0.54 |
| ▸ | CA5A | P35218 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.54 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CTSV | O60911 | 1/20 | 0.45 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | TTR | P02766 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10832679 | 0.81 | C5AR1 (0.51) | GAAALDH1A1CTSVCTSLMEN1 | |
| SCHEMBL11453114 | 0.80 | ALDH1A1 (0.56) | GAAALDH1A1CTSLACHEKMT2A | |
| SCHEMBL6412094 | 0.80 | SMPD1 (0.54) | ALDH1A1CTSVCTSLMEN1KMT2A | |
| SCHEMBL3661649 | 0.80 | TSHR (0.55) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL11454434 | 0.80 | ALDH1A1 (0.54) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL6081043 | 0.79 | ALDH1A1 (0.64) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL11471191 | 0.79 | POLB (0.48) | GAAALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL28532163 | 0.78 | PTPN7 (0.58) | EGFRGAABLMALDH1A1TRPV1 | |
| SCHEMBL62534 | 0.78 | ALDH1A1 (0.59) | ALDH1A1TDP1MEN1KMT2AMAPT | |
| SCHEMBL11471660 | 0.77 | ALDH1A1 (0.51) | CA12CA9GAAALDH1A1TDP1 |
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-1957073-A2 | MEDICINAL DRUG | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007066784-A2 | DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2007-06-14 | — | — | WO | disclosed |