Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.41 |
| ▸ | DRD4 | P21917 | 3/20 | 0.41 |
| ▸ | DRD3 | P35462 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | PLD2 | O14939 | 2/20 | 0.39 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3670664 | 0.96 | CALCRL (0.46) | CYP3A4CALCRLOPRM1OPRK1OPRL1 | |
| SCHEMBL3806376 | 0.95 | CYP3A4 (0.44) | CYP3A4CALCRLOPRM1OPRK1OPRL1 | |
| SCHEMBL3806256 | 0.95 | CYP3A4 (0.40) | CYP3A4CALCRLOPRM1OPRK1OPRL1 | |
| SCHEMBL1835272 | 0.91 | OPRM1 (0.50) | OPRM1OPRK1OPRL1BCHEACHE | |
| SCHEMBL3403017 | 0.91 | OPRM1 (0.50) | OPRM1OPRK1OPRL1BCHEACHE | |
| SCHEMBL1834696 | 0.91 | OPRM1 (0.41) | OPRM1OPRK1OPRL1BCHEACHE | |
| SCHEMBL3400388 | 0.89 | TNKS (0.42) | CYP3A4OPRM1OPRK1OPRL1BCHE | |
| SCHEMBL1838933 | 0.89 | TNKS (0.42) | CYP3A4OPRM1OPRK1OPRL1BCHE | |
| SCHEMBL1838442 | 0.88 | TNKS (0.42) | CYP3A4CALCRLOPRM1OPRK1OPRL1 | |
| SCHEMBL1838176 | 0.87 | OPRK1 (0.50) | CYP3A4OPRM1OPRK1OPRL1BCHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-2160098-B1 | USE OF COMPOUNDS HAVING A MONOGALACTOSYLDIACYLGLYCEROL SYNTHASE INHIBITORY ACTIVITY AS HERBICIDE OR ALGAECIDE, HERBICIDE AND ALGAECIDE COMPOSITIONS | COMMISSARIAT ENERGIE ATOMIQUE (FR) | 2010-11-10 | — | — | EP | claimed |