Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.36 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Propane SCHEMBL28762288 | 0.88 | TSHR (0.44) | TSHRALDH1A1CYP2D6CYP2C19HIF1A | |
| SCHEMBL138469 | 0.84 | — | — | |
| Bromide SCHEMBL258976 | 0.81 | — | — | |
| Ethane SCHEMBL4575320 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL10470923 | 0.81 | — | — | |
| Ethylene Glycol SCHEMBL3726741 | 0.79 | TSHR (0.42) | TSHRALDH1A1CYP2D6CYP2C19HIF1A | |
| Ethylene Glycol SCHEMBL36867 | 0.79 | TSHR (0.42) | TSHRALDH1A1CYP2D6CYP2C19HIF1A | |
| Octane SCHEMBL28880960 | 0.78 | PPARD (0.50) | TSHRALDH1A1KMT2AMEN1PPARA | |
| Octane SCHEMBL28958535 | 0.78 | PPARD (0.50) | TSHRALDH1A1KMT2AMEN1PPARA | |
| Ethylene SCHEMBL21581919 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3350232-B1 | FUEL COMPOSITION COMPRISING A BLOCK COPOLYMER AS DETERGENT ADDITIVE | TOTALENERGIES ONETECH (FR) | 2023-06-07 | — | — | EP | disclosed |