Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 15/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 14/20 | 0.56 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | F2 | P00734 | 2/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9967016 | 0.94 | ESR1 (0.64) | ESR1ESR2F2 | |
| SCHEMBL9967048 | 0.93 | ESR1 (0.66) | ESR1ESR2F2 | |
| SCHEMBL9967047 | 0.93 | ESR1 (0.66) | ESR1ESR2F2 | |
| SCHEMBL9967056 | 0.91 | ESR1 (0.54) | ESR1ESR2LTA4HF2 | |
| SCHEMBL9967049 | 0.90 | ESR1 (0.54) | ESR1ESR2F2 | |
| SCHEMBL9966797 | 0.88 | LTA4H (0.55) | ESR1ESR2LTA4H | |
| SCHEMBL9966888 | 0.88 | ESR1 (0.64) | ESR1ESR2LTA4HF2 | |
| SCHEMBL9966816 | 0.87 | ESR1 (0.60) | ESR1ESR2LTA4HF2XDH | |
| Hydrochloric Acid SCHEMBL9942699 | 0.87 | LTA4H (0.54) | ESR1ESR2LTA4H | |
| SCHEMBL9967059 | 0.86 | ESR1 (0.59) | ESR1ESR2LTA4HF2XDH |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012079154-A1 | SELECTIVE ESTROGEN RECEPTOR MODULATORS | DALHOUSIE UNIVERSITY (CA) | 2012-06-21 | — | — | WO | disclosed |