Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 11/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 10/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | PTPRB | P23467 | 1/20 | 0.32 |
| ▸ | PTGES | O14684 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6499280 | 0.84 | PKM (0.39) | ESR1ESR2PTGS2PTPRBPTGES | |
| SCHEMBL7803616 | 0.82 | ESR1 (0.37) | ESR1ESR2PTGS2PTPRBPTGES | |
| SCHEMBL10916295 | 0.67 | KDM4E (0.49) | ESR1ESR2 | |
| SCHEMBL23717227 | 0.67 | PIK3CD (0.31) | — | |
| SCHEMBL20113251 | 0.67 | FFAR2 (0.35) | FFAR2 | |
| SCHEMBL21579324 | 0.67 | HTR1A (0.39) | PTPRB | |
| SCHEMBL23528164 | 0.67 | FFAR2 (0.38) | FFAR2 | |
| SCHEMBL24676860 | 0.66 | FFAR2 (0.36) | FFAR2 | |
| SCHEMBL9908284 | 0.66 | CYP3A4 (0.38) | PTGS2FFAR2 | |
| Isobutesrol SCHEMBL5694505 | 0.66 | ESR1 (1.00) | ESR1ESR2TAAR1SLC6A2 |
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-6881736-B1 | Vitronectin receptor antagonists | SMITHKLINE BEECHAM CORPORATION (US) | 2005-04-19 | — | — | US | disclosed |