Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL416260 | 0.91 | KCNN4 (0.47) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| SCHEMBL30581193 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Fluoride SCHEMBL28904466 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Fluoride SCHEMBL28904468 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Fluoride SCHEMBL8188285 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Hydrochloric Acid SCHEMBL28904470 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Bromide SCHEMBL102597 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Hydrochloric Acid SCHEMBL28904471 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Iodide SCHEMBL114296 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Hydrochloric Acid SCHEMBL113885 | 0.88 | KCNN4 (0.45) | ALDH1A1ALOX15ESR1ESR2CYP3A4 |
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-4820795-A | CONTAINING GERMANIUM OR TITANIUM CATALYST RESIDUES AND PHOSPHORIC ACID STABILIZER, COSMETICS, BEVERAGES | TOYO SEIKAN KAISHA, LTD. (JP) | 1989-04-11 | — | — | US | disclosed |