Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 7/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 7/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 5/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12410085 | 1.00 | CYP19A1 (0.38) | CYP19A1CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL12410117 | 0.86 | CYP19A1 (0.37) | CYP19A1CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL27878050 | 0.83 | CYP19A1 (0.41) | CYP19A1TDP1CA1CA2CA12 | |
| SCHEMBL28297151 | 0.80 | CYP19A1 (0.40) | CYP19A1TDP1CA1CA2CA12 | |
| SCHEMBL27555132 | 0.77 | GAA (0.38) | CYP19A1TDP1CA1CA2CA12 | |
| SCHEMBL12473296 | 0.76 | CHRNB2 (0.40) | CYP19A1CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL17468967 | 0.75 | CYP19A1 (0.44) | CYP19A1TDP1CA1CA2CA12 | |
| SCHEMBL12410084 | 0.75 | CHRNB2 (0.39) | CYP19A1CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL7218815 | 0.74 | CA2 (0.45) | CYP19A1CHRNB2CHRNA4TDP1CA1 | |
| SCHEMBL901332 | 0.74 | CYP19A1 (0.49) | CYP19A1TDP1CA1CA2CA12 |
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-3520613-A1 | USE OF ESTER AMIDES AS SOLVENTS, ESTER AMIDES AS SUCH, AND METHOD FOR PREPARING ESTER AMIDES | Rhodia Operations (FR) | 2019-08-07 | — | — | EP | disclosed |