Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 3/20 | 0.41 |
| ▸ | THRA | P10827 | 6/20 | 0.41 |
| ▸ | THRB | P10828 | 6/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL5729515 | 0.77 | APP (0.44) | STAT3CHEK2KDRCXCR1ESR1 | |
| SCHEMBL5729608 | 0.72 | STAT3 (0.48) | STAT3KDM4EESR1 | |
| SCHEMBL5730104 | 0.71 | ESR1 (0.50) | THRATHRBSTAT3KDM4EESR1 | |
| Hydrochloric Acid SCHEMBL6766115 | 0.70 | ESR1 (0.49) | THRATHRBSTAT3KDM4EESR1 | |
| SCHEMBL5730175 | 0.68 | PTGS1 (0.38) | CHEK1THRATHRBSTAT3ESR1 | |
| SCHEMBL5729665 | 0.68 | APP (0.55) | ESR1 | |
| SCHEMBL5730058 | 0.67 | ESR1 (0.46) | STAT3KDM4EPTPN1ESR1 | |
| SCHEMBL5728506 | 0.67 | ESR1 (0.43) | KDM4EPTPN1ESR1 | |
| SCHEMBL7846360 | 0.67 | PPARD (0.33) | KDM4E | |
| SCHEMBL6057395 | 0.66 | ALDH1A1 (0.57) | THRATHRBKDM4EESR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1102755-A1 | SUBSTITUTED ISOXAZOLE DERIVATIVES AS ESTROGEN RECEPTOR MODULATORS | CHIRON CORPORATION (US) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000008001-A1 | SUBSTITUTED ISOXAZOLE AS ESTROGEN RECEPTOR MODULATORS | CHIRON CORPORATION (US) | 2000-02-17 | — | — | WO | disclosed |