Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL4242995 | 0.71 | ALDH1A1 (0.48) | ALDH1A1TSHRELANEMAPTALOX15 | |
| SCHEMBL13973388 | 0.69 | ALDH1A1 (0.42) | ALDH1A1TSHRGABRA1GABRB1ELANE | |
| SCHEMBL20806051 | 0.66 | MAPK13 (0.45) | ALDH1A1PTGS2MAPTHPGDMEN1 | |
| SCHEMBL210845 | 0.66 | ALDH1A1 (0.38) | ALDH1A1TSHRELANEPTGS2PTGS1 | |
| SCHEMBL18197334 | 0.66 | PTGS1 (0.40) | ALDH1A1TSHRGABRA1GABRB1ELANE | |
| SCHEMBL3643054 | 0.65 | ALDH1A1 (0.37) | ALDH1A1TSHRELANEPTGS2PTGS1 | |
| Benzophenone SCHEMBL2955921 | 0.65 | ALDH1A1 (0.78) | ALDH1A1TSHRELANEMAPTHPGD | |
| SCHEMBL3041974 | 0.64 | ALDH1A1 (0.36) | ALDH1A1TSHRGABRA1GABRB1ELANE | |
| Benzophenone SCHEMBL11655436 | 0.63 | ALDH1A1 (0.74) | ALDH1A1TSHRELANEKDM4EMAPT | |
| SCHEMBL2470211 | 0.63 | ALDH1A1 (0.42) | ALDH1A1GABRA1GABRB1ELANEPTGS2 |
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-2463866-B1 | Process for producing polymer electrolyte molded product, polymer electrolyte material, polymer electrolyte membrane, and solid polymer electrolyte fuel cell | TORAY INDUSTRIES (JP) | 2016-11-09 | — | — | EP | disclosed |