Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 2/20 | 0.45 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.40 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 2/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | FPR1 | P21462 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL178118 | 0.91 | DGAT1 (0.47) | NTRK1P2RY1DGAT1EPHX2KDR | |
| SCHEMBL174941 | 0.89 | DGAT1 (0.46) | DGAT1KDRMEN1KMT2A | |
| SCHEMBL176237 | 0.84 | DGAT1 (0.51) | DGAT1KDRCA12CA1CA2 | |
| SCHEMBL15022122 | 0.81 | EPHX2 (0.44) | NTRK1P2RY1DGAT1EPHX2KDR | |
| SCHEMBL178250 | 0.80 | EPHX2 (0.43) | NTRK1P2RY1DGAT1EPHX2KDR | |
| SCHEMBL15021989 | 0.80 | EPHX2 (0.47) | P2RY1DGAT1EPHX2KDRCA12 | |
| SCHEMBL175407 | 0.80 | DGAT1 (0.47) | DGAT1KDR | |
| SCHEMBL178117 | 0.78 | EPHX2 (0.45) | NTRK1P2RY1DGAT1EPHX2KDR | |
| SCHEMBL164989 | 0.78 | DGAT1 (0.48) | P2RY1DGAT1EPHX2KDRMEN1 | |
| SCHEMBL162274 | 0.76 | DGAT1 (0.45) | NTRK1P2RY1DGAT1EPHX2KDR |
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 |