Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 9/20 | 0.47 |
| ▸ | CA2 | P00918 | 9/20 | 0.47 |
| ▸ | CA9 | Q16790 | 7/20 | 0.47 |
| ▸ | CA12 | O43570 | 7/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.47 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.37 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.36 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7741652 | 0.89 | LTA4H (0.55) | LTA4HLMNAALDH1A1PGRL3MBTL1 | |
| SCHEMBL7733596 | 0.86 | HSD11B1 (0.43) | CA1CA2CA9CA12CA14 | |
| SCHEMBL7738083 | 0.85 | ALDH1A1 (0.39) | CA1CA2CA9CA12CA14 | |
| SCHEMBL454458 | 0.84 | HTR6 (0.42) | CA1CA2CA9CA12CA14 | |
| SCHEMBL5403499 | 0.79 | KMT2A (0.46) | KEAP1ALDH1A1 | |
| SCHEMBL52310 | 0.79 | VDR (0.46) | CA1CA2CA9CA12CA7 | |
| SCHEMBL10492049 | 0.78 | VDR (0.45) | CA1CA2CA9CA12CA7 | |
| SCHEMBL7739940 | 0.77 | CA12 (0.35) | CA1CA2CA9CA12CA14 | |
| SCHEMBL2634850 | 0.77 | LMNA (0.50) | CA1CA2LMNAKEAP1ALDH1A1 | |
| SCHEMBL547538 | 0.75 | PTGS2 (0.41) | CA1CA2CA9KEAP1ALDH1A1 |
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-6416928-B1 | HALOGENONIUM OR SULFONIUM SALTS OF SULFONATED DIPHENYLALKANE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-07-09 | — | — | US | disclosed |