Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALPG | P10696 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7003804 | 0.83 | KDM4E (0.50) | SMN1; SMN2PLA2G7LMNAHPGDALDH1A1 | |
| SCHEMBL8768148 | 0.77 | TDP1 (0.50) | SMN1; SMN2PTGS2LMNAALDH1A1TDP1 | |
| SCHEMBL8593684 | 0.75 | CES2 (0.59) | SMN1; SMN2NPC1RAB9APLA2G7LMNA | |
| Benzoic Acid SCHEMBL27844689 | 0.74 | ALDH1A1 (0.67) | SMN1; SMN2NPC1RAB9APLA2G7ALDH1A1 | |
| SCHEMBL7209286 | 0.73 | KDM4E (0.55) | TYRRAB9ALMNAHPGDALDH1A1 | |
| Benzaldehyde SCHEMBL28297125 | 0.73 | ALDH1A1 (0.70) | SMN1; SMN2NPC1RAB9AALDH1A1CYP2A6 | |
| SCHEMBL28349357 | 0.73 | ALDH1A1 (0.53) | SMN1; SMN2NPC1RAB9APTGS2PLA2G7 | |
| SCHEMBL11267446 | 0.73 | TDP1 (0.42) | RAB9ALMNAALDH1A1TDP1 | |
| Methyl Alcohol SCHEMBL28227404 | 0.71 | CYP2A6 (0.52) | TYRALDH1A1CYP2A6NFE2L2 | |
| SCHEMBL6905265 | 0.70 | HDAC1 (0.58) | LMNATDP1HDAC3HDAC4HDAC1 |
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-1268389-A2 | HALOGENATED TRIPHENYLETHYLENE DERIVATIVES AS SELECTIVE ESTROGEN RECEPTOR MODULATORS | Bristol-Myers Squibb Pharma Company (US) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001077057-A2 | HALOGENATED TRIPHENYLETHYLENE DERIVATIVES AS SELECTIVE ESTROGEN RECEPTOR MODULATORS | DUPONT PHARMACEUTICALS COMPANY (US) | 2001-10-18 | — | — | WO | disclosed |