Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | ITK | Q08881 | 2/20 | 0.40 |
| ▸ | ATP4A | P20648 | 2/20 | 0.40 |
| ▸ | ATP4B | P51164 | 2/20 | 0.40 |
| ▸ | CBFB | Q13951 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL695181 | 0.82 | NPSR1 (0.37) | CYP1A2CBFBNPSR1KIF11KDM4E | |
| SCHEMBL695340 | 0.77 | AURKA (0.56) | GSK3BAURKAAURKBNPC1RAB9A | |
| SCHEMBL4893046 | 0.76 | NPC1 (0.65) | GSK3BNPC1RAB9ACYP19A1CYP1A2 | |
| SCHEMBL30047184 | 0.76 | NPC1 (0.65) | GSK3BNPC1RAB9ACYP19A1CYP1A2 | |
| SCHEMBL26053444 | 0.74 | GSK3B (0.55) | GSK3BAURKAAURKBNPC1RAB9A | |
| SCHEMBL13394219 | 0.73 | AURKA (0.49) | GSK3BAURKAAURKBNPC1RAB9A | |
| SCHEMBL308319 | 0.73 | GSK3B (0.61) | GSK3BAURKAAURKBNPC1RAB9A | |
| SCHEMBL29470995 | 0.73 | GSK3B (0.61) | GSK3BAURKAAURKBNPC1RAB9A | |
| SCHEMBL23416953 | 0.71 | NPSR1 (0.45) | RAB9ANPSR1KIF11KDRKDM4E | |
| SCHEMBL29797725 | 0.71 | NPSR1 (0.45) | RAB9ANPSR1KIF11KDRKDM4E |
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-2421848-A1 | AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS | Janssen Pharmaceutica N.V. (BE) | 2012-02-29 | — | — | EP | claimed |
| WO-2010124119-A1 | AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2010-10-28 | — | — | WO | claimed |