Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | TYR | P14679 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | ESR1 | P03372 | 5/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.35 |
| ▸ | AR | P10275 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL232506 | 0.82 | ESR1 (0.42) | ALDH1A1ESR1ESR2ARSMN1; SMN2 | |
| SCHEMBL529617 | 0.82 | ESR1 (0.48) | BCHETYRACHEALDH1A1ESR1 | |
| SCHEMBL29459520 | 0.82 | ESR1 (0.48) | BCHETYRACHEALDH1A1ESR1 | |
| SCHEMBL28042537 | 0.79 | TP53 (0.57) | ALDH1A1ESR1ESR2ARSMN1; SMN2 | |
| Methylhydroquinone SCHEMBL1357054 | 0.79 | ESR1 (0.40) | ALDH1A1ESR1ESR2ARSMN1; SMN2 | |
| SCHEMBL27994199 | 0.77 | TDP1 (0.49) | ALDH1A1SMN1; SMN2GLATDP1CYP3A4 | |
| SCHEMBL8677762 | 0.77 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2GLATDP1CYP3A4 | |
| SCHEMBL27028822 | 0.77 | ESR1 (0.62) | ALDH1A1ESR1ESR2ARSMN1; SMN2 | |
| SCHEMBL234097 | 0.76 | ALDH1A1 (0.36) | ALDH1A1ESR1SMN1; SMN2TDP1CYP3A4 | |
| SCHEMBL27479104 | 0.76 | CNR1 (0.46) | ALDH1A1ESR1ESR2ARSMN1; SMN2 |
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-5844053-A | Organo-polysiloxane derivartives | NAGASE-CIBA, LTD. (JP) | 1998-12-01 | — | — | US | disclosed |