Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.53 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.53 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7940868 | 0.81 | CYP2A6 (0.58) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 | |
| SCHEMBL13592024 | 0.78 | CYP2A6 (0.50) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 | |
| SCHEMBL10406976 | 0.78 | CYP2A6 (0.50) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 | |
| SCHEMBL693906 | 0.76 | CYP2A6 (0.59) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 | |
| SCHEMBL1821918 | 0.76 | CYP2A6 (0.60) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 | |
| SCHEMBL10406611 | 0.75 | CYP2A6 (0.47) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 | |
| SCHEMBL693705 | 0.74 | ACHE (0.42) | CYP2C19CYP2C9PGRACHEKDM4E | |
| SCHEMBL6139747 | 0.73 | KMO (0.51) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 | |
| SCHEMBL13130594 | 0.73 | CYP2A6 (0.61) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 | |
| SCHEMBL10406260 | 0.72 | CYP2A6 (0.46) | CYP2A6CYP3A4CYP2C19CYP2B6CYP2E1 |
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-2421825-A1 | AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS | Janssen Pharmaceutica N.V. (BE) | 2012-02-29 | — | — | EP | claimed |
| WO-2010124108-A1 | AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2010-10-28 | — | — | WO | claimed |