Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.35 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ESRRB | O95718 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL7105090 | 0.88 | SMN1; SMN2 (0.46) | ZDHHC7SMN1; SMN2CA1CA2CA14 | |
| SCHEMBL7707505 | 0.81 | SMN1; SMN2 (0.41) | ZDHHC7SMN1; SMN2CA1CA2CA14 | |
| SCHEMBL9509857 | 0.79 | ALDH1A1 (0.40) | ZDHHC7SMN1; SMN2CA1CA2CA14 | |
| SCHEMBL1007906 | 0.79 | — | — | |
| SCHEMBL13640440 | 0.78 | CA1 (0.45) | ZDHHC7SMN1; SMN2CA1CA2CA14 | |
| SCHEMBL19526547 | 0.77 | SMN1; SMN2 (0.38) | ZDHHC7SMN1; SMN2CA1CA2CA14 | |
| SCHEMBL1367718 | 0.77 | SMN1; SMN2 (0.38) | ZDHHC7SMN1; SMN2CA1CA2CA14 | |
| SCHEMBL184608 | 0.76 | — | — | |
| SCHEMBL11375638 | 0.76 | — | — | |
| SCHEMBL15314124 | 0.76 | — | — |
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-2018010932-A1 | CATALYTIC CARBOXYLATION OF ACTIVATED ALKANES AND/OR OLEFINS | FUNDACIÓ INSTITUT CATALÀ D'INVESTIGACIÓ QUÍMICA (ES) | 2018-01-18 | — | — | WO | disclosed |