Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.48 |
| ▸ | DGAT1 | O75907 | 7/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | CTSC | P53634 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL162773 | 0.89 | DGAT1 (0.57) | EPHX2DGAT1CA12CA1CA2 | |
| SCHEMBL15022055 | 0.87 | DGAT1 (0.47) | EPHX2DGAT1CA12CA1CA2 | |
| SCHEMBL162774 | 0.87 | DGAT1 (0.43) | EPHX2DGAT1CA12CA1CA2 | |
| SCHEMBL173959 | 0.87 | DGAT1 (0.60) | DGAT1CA12CA1CA2CA9 | |
| SCHEMBL161965 | 0.85 | DGAT1 (0.44) | EPHX2DGAT1CA12CA1CA2 | |
| SCHEMBL162528 | 0.81 | KDR (0.40) | DGAT1CA12CA1CA2CA9 | |
| SCHEMBL24829931 | 0.78 | NAMPT (0.48) | DGAT1 | |
| SCHEMBL160987 | 0.78 | DGAT1 (0.59) | DGAT1CA12CA1CA2CA9 | |
| SCHEMBL162780 | 0.78 | DGAT1 (0.61) | DGAT1CA12CA1CA2CA9 | |
| SCHEMBL163112 | 0.77 | DGAT1 (0.58) | DGAT1CA12CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2611783-A2 | HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS | Piramal Enterprises Limited (IN) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012029032-A2 | HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS | PIRAMAL LIFE SCIENCES LIMITED (IN) | 2012-03-08 | — | — | WO | disclosed |