Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.36 |
| ▸ | ELANE | P08246 | 10/20 | 0.34 |
| ▸ | CNR1 | P21554 | 7/20 | 0.34 |
| ▸ | CNR2 | P34972 | 6/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4681581 | 0.95 | ELANE (0.38) | MGLLELANECYP2C9KLKB1 | |
| SCHEMBL4796795 | 0.91 | ELANE (0.34) | MGLLELANECYP2C9 | |
| SCHEMBL4683968 | 0.90 | CNR1 (0.37) | MGLLCNR1CNR2CYP2C9KLKB1 | |
| SCHEMBL4968374 | 0.88 | CNR1 (0.39) | MGLLCNR1CNR2CYP2C9KLKB1 | |
| SCHEMBL4080122 | 0.88 | CNR1 (0.40) | MGLLCNR1CNR2 | |
| SCHEMBL5727699 | 0.86 | CNR1 (0.38) | MGLLCNR1CNR2 | |
| SCHEMBL4684135 | 0.85 | OPRD1 (0.41) | — | |
| SCHEMBL4966303 | 0.84 | MGLL (0.40) | MGLLKLKB1 | |
| SCHEMBL4787427 | 0.84 | CNR1 (0.36) | MGLLCNR1CNR2KLKB1 | |
| SCHEMBL1500546 | 0.83 | MGLL (0.37) | MGLLELANECNR1CNR2CYP2C9 |
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-1960392-A2 | HETEROCYCLE-SUBSTITUTED 3-ALKYL AZETIDINE DERIVATIVES | Merck & Co., Inc. (US) | 2008-08-27 | — | — | EP | disclosed |
| WO-2007064566-A2 | HETEROCYCLE-SUBSTITUTED 3-ALKYL AZETIDINE DERIVATIVES | MERCK & CO., INC. (US) | 2007-06-07 | — | — | WO | disclosed |