Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 7/20 | 0.46 |
| ▸ | PTPN5 | P54829 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PGK1 | P00558 | 1/20 | 0.36 |
| ▸ | PGK2 | P07205 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1284428 | 0.92 | PGK1 (0.40) | KIF11PGK1PGK2ESR1ESR2 | |
| SCHEMBL8560690 | 0.83 | USP2 (0.43) | CYP2C9PGK1PGK2ESR1ESR2 | |
| SCHEMBL9508396 | 0.83 | ESR1 (0.56) | KIF11PGK1PGK2ESR1ESR2 | |
| SCHEMBL1357633 | 0.82 | ALDH1A1 (0.50) | KIF11CYP2C9PGK1PGK2NR1H2 | |
| SCHEMBL4982243 | 0.81 | KIF11 (0.46) | KIF11PGK1PGK2ESR1ESR2 | |
| SCHEMBL2776477 | 0.81 | MLYCD (0.50) | PTPN5CYP2C9NR1H2NR1H3CA1 | |
| SCHEMBL1134055 | 0.76 | ALDH1A1 (0.44) | PGK1PGK2ESR1ESR2NR1H2 | |
| SCHEMBL6339219 | 0.76 | MEN1 (0.42) | KIF11NR1H2NR1H3 | |
| SCHEMBL11410841 | 0.76 | KIF11 (0.52) | KIF11NR1H2NR1H3 | |
| SCHEMBL16439869 | 0.75 | KIF11 (0.65) | KIF11PTPN5CYP2C9 |
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-5118874-A | Intermediates for polycondensates | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-06-02 | — | — | US | disclosed |