Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 5/20 | 0.34 |
| ▸ | KDM5A | P29375 | 4/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.32 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.32 |
| ▸ | KDM4A | O75164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL78617 | 0.72 | DNM1 (0.47) | DNM1CA12CA9S1PR2S1PR1 | |
| SCHEMBL9491049 | 0.69 | DNM1 (0.45) | DNM1CA12CA9S1PR2S1PR1 | |
| Fluoride SCHEMBL1995826 | 0.69 | DNM1 (0.45) | DNM1CA12CA9S1PR2S1PR1 | |
| SCHEMBL3779898 | 0.69 | — | — | |
| SCHEMBL29580877 | 0.69 | CA12 (0.47) | DNM1CA12CA9S1PR2S1PR1 | |
| SCHEMBL29581377 | 0.69 | CA12 (0.47) | DNM1CA12CA9S1PR2S1PR1 | |
| Bromide SCHEMBL1993994 | 0.69 | DNM1 (0.50) | DNM1CA12CA9S1PR2S1PR1 | |
| Hydrochloric Acid SCHEMBL1997515 | 0.69 | DNM1 (0.50) | DNM1CA12CA9S1PR2S1PR1 | |
| SCHEMBL9188133 | 0.69 | CA12 (0.47) | DNM1CA12CA9S1PR2S1PR1 | |
| SCHEMBL2058202 | 0.69 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0623608-B1 | BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL PREPARATION CONTAINING THE SAME AS ACTIVE INGREDIENT | TEIJIN LTD (JP) | 2001-05-30 | — | — | EP | disclosed |