Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.44 |
| ▸ | FABP7 | O15540 | 1/20 | 0.40 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | NAAA | Q02083 | 2/20 | 0.38 |
| ▸ | MMP9 | P14780 | 2/20 | 0.38 |
| ▸ | MMP12 | P39900 | 2/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7775106 | 0.83 | EPHX1 (0.41) | EPHX1FABP7FABP5CYP2C19CA12 | |
| SCHEMBL4336849 | 0.83 | EPHX1 (0.41) | EPHX1FABP7FABP5CYP2C19CA12 | |
| SCHEMBL27795896 | 0.83 | EPHX1 (0.39) | EPHX1FABP7FABP5CYP2C19CA12 | |
| SCHEMBL2637808 | 0.81 | NOS2 (0.42) | EPHX1FABP7FABP5 | |
| SCHEMBL2678468 | 0.79 | EPHX1 (0.48) | EPHX1FABP7FABP5CYP2C19CA12 | |
| SCHEMBL11038809 | 0.79 | EPHX1 (0.48) | EPHX1FABP7FABP5CYP2C19CA12 | |
| SCHEMBL170007 | 0.79 | EPHX1 (0.48) | EPHX1FABP7FABP5CYP2C19CA12 | |
| SCHEMBL24595803 | 0.79 | EPHX1 (0.48) | EPHX1FABP7FABP5CYP2C19CA12 | |
| SCHEMBL17061158 | 0.79 | EPHX1 (0.48) | EPHX1FABP7FABP5CYP2C19CA12 | |
| SCHEMBL17061159 | 0.79 | EPHX1 (0.48) | EPHX1FABP7FABP5CYP2C19CA12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022149617-A1 | COMPOUND LIBRARY | 中外製薬株式会社 | 2022-07-14 | — | — | WO | disclosed |