Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.34 |
| ▸ | CA9 | Q16790 | 4/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3674320 | 1.00 | CA12 (0.34) | CA12CA9CA1CA2EPHX1 | |
| SCHEMBL3674322 | 1.00 | CA12 (0.34) | CA12CA9CA1CA2EPHX1 | |
| SCHEMBL15750117 | 1.00 | CA12 (0.34) | CA12CA9CA1CA2EPHX1 | |
| SCHEMBL9013516 | 1.00 | CA12 (0.34) | CA12CA9CA1CA2EPHX1 | |
| SCHEMBL12054453 | 1.00 | CA12 (0.34) | CA12CA9CA1CA2EPHX1 | |
| SCHEMBL3678451 | 0.98 | RAB9A (0.33) | CA12CA9CA1CA2EPHX1 | |
| SCHEMBL1571430 | 0.92 | MAPT (0.34) | CA12CA9CA1CA2MAPT | |
| SCHEMBL17777177 | 0.92 | MAPT (0.34) | CA12CA9CA1CA2MAPT | |
| SCHEMBL9247730 | 0.92 | MAPT (0.34) | CA12CA9CA1CA2MAPT | |
| SCHEMBL11414567 | 0.86 | CA12 (0.41) | CA12CA9CA1CA2EPHX1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1071736-C | A process for the preparation of carboxylic esters derived from allylic alcohols | FIRMENICH & CIE (CH) | 2001-09-26 | — | — | CN | disclosed |
| US-5554786-A | Process for the preparation of carboxylic esters defined from allylic alcohols | FIRMENICH S.A. (CH) | 1996-09-10 | — | — | US | disclosed |
| CN-1113226-A | A process for the preparation of carboxylic esters derived from allylic alcohols | FIRMENICH & CIE (CH) | 1995-12-13 | — | — | CN | disclosed |