Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 2/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | VNN1 | O95497 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15509295 | 1.00 | NSD2 (0.49) | NSD2GSK3BEPHX2ALDH1A1MAPT | |
| SCHEMBL15516651 | 1.00 | NSD2 (0.49) | NSD2GSK3BEPHX2ALDH1A1MAPT | |
| SCHEMBL19367865 | 0.78 | GSK3B (0.59) | NSD2GSK3BEPHX2MAPTVNN1 | |
| SCHEMBL9756773 | 0.76 | NPC1 (0.52) | ALDH1A1MAPTRAB9ACA1CA2 | |
| SCHEMBL28365872 | 0.75 | CES2 (0.43) | ALDH1A1MAPTRAB9ACA1CA2 | |
| SCHEMBL2556035 | 0.73 | GSK3B (0.61) | GSK3BALDH1A1MAPTRAB9ACA1 | |
| SCHEMBL7935350 | 0.72 | VNN1 (0.60) | NSD2GSK3BEPHX2ALDH1A1VNN1 | |
| SCHEMBL8110686 | 0.72 | NSD2 (0.56) | NSD2GSK3BEPHX2VNN1RAB9A | |
| SCHEMBL20837775 | 0.71 | SLC6A3 (0.48) | EPHX2ALDH1A1MAPT | |
| SCHEMBL10996566 | 0.71 | MAPT (0.50) | GSK3BALDH1A1MAPTRAB9APTPN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014037963-A1 | A PROCESS FOR THE SYNTHESIS OF β, ƴ UNSATURATED KETONES | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2014-03-13 | — | — | WO | claimed |
| WO-2014037963-A1 | A PROCESS FOR THE SYNTHESIS OF β, ƴ UNSATURATED KETONES | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2014-03-13 | — | — | WO | disclosed |