Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | FDPS | P14324 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.43 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.43 |
| ▸ | ABAT | P80404 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9707979 | 0.84 | TUBB1 (0.50) | — | |
| SCHEMBL498989 | 0.83 | ALDH1A1 (0.64) | ALDH1A1TSHRFDPSPOLBAOX1 | |
| SCHEMBL30504088 | 0.83 | ALDH1A1 (0.64) | ALDH1A1TSHRFDPSPOLBAOX1 | |
| SCHEMBL9707833 | 0.78 | ALDH1A1 (0.57) | ALDH1A1TSHRFDPSPOLBAOX1 | |
| SCHEMBL22428 | 0.77 | ALDH1A1 (0.64) | ALDH1A1TSHRFDPSPOLBAOX1 | |
| SCHEMBL36740 | 0.75 | ALDH1A1 (0.50) | ALDH1A1TSHRFDPSPOLBAOX1 | |
| SCHEMBL30360260 | 0.75 | ALDH1A1 (0.50) | ALDH1A1TSHRFDPSPOLBAOX1 | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL25202 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TSHRFDPSAOX1TRIM24 | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL5308959 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TSHRFDPSAOX1TRIM24 | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL1330962 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TSHRFDPSAOX1TRIM24 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992016486-A1 | SUBSTITUTED DIPHENYLETHYLENES AND ANALOGUES OR DERIVATIVES THEREOF | ASTON MOLECULES LIMITED (GB) | 1992-10-01 | — | — | WO | claimed |
| WO-1992016486-A1 | SUBSTITUTED DIPHENYLETHYLENES AND ANALOGUES OR DERIVATIVES THEREOF | ASTON MOLECULES LIMITED (GB) | 1992-10-01 | — | — | WO | disclosed |