Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 20/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL20143175 | 1.00 | ESR1 (0.58) | ESR1ESR2HDAC6 | |
| SCHEMBL19439349 | 0.93 | ESR1 (0.60) | ESR1ESR2 | |
| SCHEMBL19454289 | 0.93 | ESR1 (0.60) | ESR1ESR2 | |
| SCHEMBL19439321 | 0.93 | ESR1 (0.60) | ESR1ESR2 | |
| SCHEMBL19454227 | 0.90 | ESR1 (0.65) | ESR1ESR2HDAC6 | |
| SCHEMBL19454226 | 0.90 | ESR1 (0.65) | ESR1ESR2HDAC6 | |
| SCHEMBL19454230 | 0.90 | ESR1 (0.65) | ESR1ESR2HDAC6 | |
| SCHEMBL19439359 | 0.88 | ESR1 (0.61) | ESR1ESR2HDAC6 | |
| SCHEMBL19439356 | 0.88 | ESR1 (0.61) | ESR1ESR2HDAC6 | |
| SCHEMBL19439319 | 0.88 | ESR1 (0.61) | ESR1ESR2HDAC6 |
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-9969732-B2 | Tetrahydroisoquinoline estrogen receptor modulators and uses thereof | GENENTECH, INC. (US) | 2018-05-15 | — | — | US | disclosed |