Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 13/20 | 0.67 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | GNPAT | O15228 | 1/20 | 0.47 |
| ▸ | PLA2G2C | Q5R387 | 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 | |
|---|---|---|---|---|
| SCHEMBL9469762 | 1.00 | NOD1 (0.67) | NOD1SLC6A5HDAC2EPHX2GNPAT | |
| SCHEMBL9831553 | 0.90 | NOD1 (0.75) | NOD1SLC6A5HDAC2GNPATPLA2G2C | |
| SCHEMBL9831556 | 0.90 | NOD1 (0.75) | NOD1SLC6A5HDAC2GNPATPLA2G2C | |
| SCHEMBL7170497 | 0.88 | NOD1 (0.84) | NOD1SLC6A5HDAC2EPHX2PLA2G2C | |
| SCHEMBL9624935 | 0.86 | NOD1 (0.87) | NOD1SLC6A5EPHX2PLA2G2C | |
| SCHEMBL9752863 | 0.86 | NOD1 (0.87) | NOD1SLC6A5EPHX2PLA2G2C | |
| SCHEMBL6143109 | 0.86 | NOD1 (0.87) | NOD1SLC6A5EPHX2PLA2G2C | |
| SCHEMBL9831223 | 0.86 | NOD1 (0.87) | NOD1SLC6A5EPHX2PLA2G2C | |
| SCHEMBL22151170 | 0.86 | NOD1 (0.87) | NOD1SLC6A5EPHX2PLA2G2C | |
| SCHEMBL8423000 | 0.86 | NOD1 (0.87) | NOD1SLC6A5EPHX2PLA2G2C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5179117-A | Enzyme inhibitors | DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-01-12 | — | — | US | disclosed |