Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.39 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL13407340 | 0.91 | ESR1 (0.35) | ESR1ESR2 | |
| SCHEMBL13407310 | 0.87 | ESR1 (0.42) | ESR1ESR2PGR | |
| SCHEMBL13407339 | 0.84 | MAPK1 (0.33) | — | |
| SCHEMBL13407338 | 0.81 | ICAM1 (0.32) | — | |
| SCHEMBL18099826 | 0.81 | APP (0.41) | ESR1ESR2 | |
| SCHEMBL16004512 | 0.80 | MAPK1 (0.37) | — | |
| SCHEMBL18099828 | 0.80 | APP (0.40) | ESR1ESR2PGR | |
| SCHEMBL13407302 | 0.76 | ESR1 (0.43) | ESR1ESR2 | |
| SCHEMBL14985732 | 0.76 | IKBKB (0.44) | ESR1ESR2 | |
| SCHEMBL2756691 | 0.76 | IKBKB (0.41) | ESR1ESR2 |
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-7700643-B2 | Polymerisable thieno[3,2-b]thiophenes | MERCK PATENT GMBH (DE) | 2010-04-20 | — | — | US | disclosed |