Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 19/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18274658 | 0.83 | SLC6A9 (0.55) | SLC6A9 | |
| SCHEMBL18274649 | 0.83 | SLC6A9 (0.54) | SLC6A9 | |
| SCHEMBL8278495 | 0.82 | SLC6A9 (0.64) | SLC6A9 | |
| SCHEMBL5039779 | 0.81 | SLC6A9 (0.63) | SLC6A9KDM4EHSD17B10 | |
| SCHEMBL8279640 | 0.79 | SLC6A9 (0.66) | SLC6A9KDM4EHSD17B10 | |
| SCHEMBL18274654 | 0.74 | SLC6A9 (0.59) | SLC6A9KDM4EHSD17B10 | |
| SCHEMBL3559578 | 0.73 | SLC6A9 (0.83) | SLC6A9 | |
| SCHEMBL761335 | 0.73 | SLC6A9 (0.83) | SLC6A9 | |
| SCHEMBL760024 | 0.71 | SLC6A9 (0.56) | SLC6A9KDM4EHSD17B10 | |
| SCHEMBL3561259 | 0.71 | SLC6A9 (0.56) | SLC6A9KDM4EHSD17B10 |
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 |