Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 15/20 | 0.37 |
| ▸ | CNR2 | P34972 | 11/20 | 0.37 |
| ▸ | MGLL | Q99685 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4968374 | 0.92 | CNR1 (0.39) | CNR1CNR2MGLLKLKB1CYP3A4 | |
| SCHEMBL4080122 | 0.91 | CNR1 (0.40) | CNR1CNR2MGLLMEN1GLA | |
| SCHEMBL4684089 | 0.90 | MGLL (0.36) | CNR1CNR2MGLLKLKB1CYP2D6 | |
| SCHEMBL5727699 | 0.90 | CNR1 (0.38) | CNR1CNR2MGLLMEN1GLA | |
| SCHEMBL4787427 | 0.87 | CNR1 (0.36) | CNR1CNR2MGLLMEN1GLA | |
| SCHEMBL5727680 | 0.85 | MGLL (0.41) | CNR1CNR2MGLLMEN1GLA | |
| SCHEMBL4681878 | 0.85 | SLC6A9 (0.37) | MEN1TSHRKMT2ACYP3A4CYP2D6 | |
| SCHEMBL4681581 | 0.85 | ELANE (0.38) | MGLLMEN1GLATSHRKMT2A | |
| SCHEMBL4966303 | 0.84 | MGLL (0.40) | MGLLMEN1GLATSHRKMT2A | |
| SCHEMBL4681476 | 0.84 | CNR1 (0.34) | CNR1CNR2MGLLMEN1GLA |
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 4 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 |
| EP-1954692-A1 | HETEROCYCLE-SUBSTITUTED 3-ALKYL AZETIDINE DERIVATIVES | Merck and Co., Inc. (US) | 2008-08-13 | — | — | EP | disclosed |
| WO-2007064566-A2 | HETEROCYCLE-SUBSTITUTED 3-ALKYL AZETIDINE DERIVATIVES | MERCK & CO., INC. (US) | 2007-06-07 | — | — | WO | disclosed |
| WO-2007062193-A1 | HETEROCYCLE-SUBSTITUTED 3-ALKYL AZETIDINE DERIVATIVES | MERCK & CO., INC. (US) | 2007-05-31 | — | — | WO | disclosed |