Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
| ▸ | ACACB | O00763 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | PPARA | Q07869 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL64192 | 0.86 | HTT (0.42) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL7739970 | 0.86 | MMP13 (0.43) | CYP19A1ALDH1A1MAPTHTTMMP13 | |
| SCHEMBL7739940 | 0.85 | CA12 (0.35) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL7739948 | 0.84 | HSD11B1 (0.43) | MEN1KMT2ACA1CA2ALDH1A1 | |
| SCHEMBL7738083 | 0.83 | ALDH1A1 (0.39) | CYP19A1CA12CA1CA2CA7 | |
| SCHEMBL7733589 | 0.79 | MEN1 (0.36) | CYP19A1MEN1KMT2ACA12CA1 | |
| SCHEMBL13098196 | 0.77 | SLC6A2 (0.40) | ALDH1A1ACACB | |
| SCHEMBL13098213 | 0.77 | SLC6A2 (0.40) | ALDH1A1ACACB | |
| SCHEMBL64775 | 0.75 | PPARA (0.32) | MEN1KMT2APPARA | |
| SCHEMBL5707386 | 0.75 | LMNA (0.34) | ALDH1A1HTTABCB1PPARA |
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 |