Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | FABP7 | O15540 | 1/20 | 0.33 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11712728 | 0.80 | EPHX1 (0.44) | EPHX1CYP19A1CYP2C19NAAAHTT | |
| SCHEMBL28305533 | 0.79 | CYP19A1 (0.43) | EPHX1CYP19A1CYP2C19NAAAL3MBTL1 | |
| SCHEMBL19690607 | 0.76 | EPHX1 (0.45) | EPHX1CYP19A1CYP2C19NAAAL3MBTL1 | |
| SCHEMBL11754227 | 0.75 | CYP2C19 (0.41) | EPHX1CYP19A1CYP2C19NAAAL3MBTL1 | |
| SCHEMBL3443147 | 0.72 | ALDH1A1 (0.50) | EPHX1CYP19A1CYP2C19NAAAL3MBTL1 | |
| SCHEMBL28167343 | 0.72 | NAAA (0.39) | EPHX1CYP19A1CYP2C19NAAAL3MBTL1 | |
| SCHEMBL19690391 | 0.72 | EPHX1 (0.38) | EPHX1CYP19A1CYP2C19NAAAL3MBTL1 | |
| SCHEMBL10981023 | 0.72 | CHRM3 (0.38) | EPHX1CYP19A1NAAALMNACHRM3 | |
| SCHEMBL6253845 | 0.72 | L3MBTL1 (0.36) | EPHX1CYP19A1CYP2C19NAAAL3MBTL1 | |
| SCHEMBL9971267 | 0.72 | CYP19A1 (0.41) | EPHX1CYP19A1CYP2C19NAAAHTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-117550943-A | Based on CO 2 Method for participating in controllable synthesis of polycarboxylic acid compounds | 四川大学 | 2024-02-13 | — | — | CN | disclosed |