Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 6/20 | 0.37 |
| ▸ | ESR1 | P03372 | 5/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 2/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10622699 | 0.87 | MEN1 (0.40) | ESR2ESR1CA12CA9MIF | |
| SCHEMBL10620226 | 0.86 | JAK1 (0.36) | ESR2ESR1TYRJAK2JAK1 | |
| SCHEMBL10619516 | 0.86 | MEN1 (0.39) | ESR2ESR1MIFFFAR1FFAR4 | |
| SCHEMBL10620087 | 0.86 | ESR1 (0.37) | ESR2ESR1MIFFFAR1FFAR4 | |
| SCHEMBL10619874 | 0.85 | ALOX5 (0.42) | ESR2ESR1TYRACHEJAK2 | |
| SCHEMBL10624462 | 0.85 | ESR2 (0.42) | ESR2ESR1MIFMAOAMAOB | |
| SCHEMBL10620193 | 0.84 | TYR (0.43) | ESR2ESR1TYRACHEMEN1 | |
| SCHEMBL10621936 | 0.84 | CDK4 (0.36) | ESR2ESR1FFAR1FFAR4TYR | |
| SCHEMBL10620156 | 0.83 | CYP3A4 (0.48) | ESR1TYRACHEMEN1TP53 | |
| SCHEMBL10624149 | 0.83 | LTA4H (0.41) | ESR1MAOAMAOBFFAR1FFAR4 |
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-4730904-A | Organosilicon compounds | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-03-15 | — | — | US | disclosed |