Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.33 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.33 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL8493067 | 0.87 | NPSR1 (0.34) | ALDH1A1MAPK1HTTL3MBTL1CA1 | |
| SCHEMBL8498317 | 0.83 | MAPT (0.36) | ALDH1A1MAPK1HTTL3MBTL1MAPT | |
| SCHEMBL3182804 | 0.81 | KIF11 (0.38) | ALDH1A1MAPK1HTTL3MBTL1CA1 | |
| SCHEMBL3203357 | 0.81 | KIF11 (0.38) | ALDH1A1MAPK1HTTL3MBTL1CA1 | |
| SCHEMBL2090403 | 0.79 | CA1 (0.50) | ALDH1A1MAPK1HTTL3MBTL1CA1 | |
| SCHEMBL31005134 | 0.79 | CA1 (0.50) | ALDH1A1MAPK1HTTL3MBTL1CA1 | |
| SCHEMBL246925 | 0.77 | KIF11 (0.40) | ALDH1A1MAPK1L3MBTL1CA4MAPT | |
| SCHEMBL246587 | 0.77 | KIF11 (0.40) | ALDH1A1MAPK1L3MBTL1CA4MAPT | |
| SCHEMBL245948 | 0.76 | SLC6A2 (0.37) | MAPTKIF11CYP1A2MEN1KMT2A | |
| SCHEMBL3199523 | 0.76 | CA1 (0.36) | ALDH1A1MAPK1HTTL3MBTL1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5624787-A | NITROGENOUS COMPOUND AND SULFONIUM COMPOUND FOR POSITIVE PHOTORESISTS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1997-04-29 | — | — | US | claimed |