Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 16/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.36 |
| ▸ | ITGA4 | P13612 | 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 | |
|---|---|---|---|---|
| SCHEMBL3556911 | 0.83 | SLC6A9 (0.69) | SLC6A9 | |
| SCHEMBL3564223 | 0.74 | SLC6A9 (0.77) | SLC6A9 | |
| SCHEMBL3561162 | 0.71 | SLC6A9 (0.77) | SLC6A9 | |
| SCHEMBL3555616 | 0.69 | SLC6A9 (0.77) | SLC6A9 | |
| SCHEMBL16510727 | 0.69 | SLC6A9 (0.66) | SLC6A9 | |
| SCHEMBL13753145 | 0.68 | CNR2 (0.60) | CNR2ITGA4 | |
| SCHEMBL3567398 | 0.67 | SLC6A9 (0.83) | SLC6A9 | |
| SCHEMBL3564548 | 0.67 | SLC6A9 (0.59) | SLC6A9 | |
| SCHEMBL4058998 | 0.66 | MBOAT4 (0.32) | SLC6A9 | |
| SCHEMBL16511242 | 0.66 | SLC6A9 (0.61) | SLC6A9P2RX7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1729772-A4 | HETEROARYL PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | MERCK & CO INC (US) | 2009-05-27 | — | — | EP | claimed |
| EP-1729772-A2 | HETEROARYL PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | Merck and Co., Inc. (US) | 2006-12-13 | — | — | EP | claimed |
| WO-2005094514-A2 | HETEROARYL PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | MERCK & CO., INC. (US) | 2005-10-13 | — | — | WO | claimed |