Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 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 | |
|---|---|---|---|---|
| SCHEMBL18519830 | 0.88 | CHRM2 (0.33) | CYP1A2PAOXTDP1ALDH1A1 | |
| SCHEMBL9074136 | 0.83 | ALDH1A1 (0.39) | TDP1FFAR3ALDH1A1ALOX15SOAT1 | |
| SCHEMBL16297673 | 0.79 | ALDH1A1 (0.37) | CYP1A2TDP1FFAR3ALDH1A1ALOX15 | |
| SCHEMBL30846825 | 0.78 | TSHR (0.40) | TDP1ALDH1A1 | |
| SCHEMBL28657431 | 0.78 | GLRA1 (0.35) | — | |
| SCHEMBL14098334 | 0.77 | — | — | |
| SCHEMBL28257704 | 0.75 | ADRA2C (0.47) | ALDH1A1 | |
| SCHEMBL10707806 | 0.75 | PAOX (0.34) | PAOX | |
| SCHEMBL19641951 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL7543140 | 0.74 | TDP1 (0.36) | TDP1FFAR3ALDH1A1SOAT1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112110891-A | Tellurolactone and method for preparing ditellurium compound by using same | 清华大学 | 2020-12-22 | — | — | CN | disclosed |
| CN-104945274-B | Novel branched fatty nylon salt, and preparation method and application thereof | 上海化工研究院 | 2017-01-11 | — | — | CN | disclosed |
| EP-0941120-A4 | BRANCHED PEPTIDE LINKERS | BRISTOL MYERS SQUIBB CO (US) | 2004-08-18 | — | — | EP | disclosed |
| EP-0941120-A1 | BRANCHED PEPTIDE LINKERS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-09-15 | — | — | EP | disclosed |
| WO-1998019705-A1 | BRANCHED PEPTIDE LINKERS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-05-14 | — | — | WO | disclosed |