Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 2/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | BHMT | Q93088 | 5/20 | 0.36 |
| ▸ | BHMT2 | Q9H2M3 | 1/20 | 0.36 |
| ▸ | NOD1 | Q9Y239 | 3/20 | 0.34 |
| ▸ | GCLC | P48506 | 1/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 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 | |
|---|---|---|---|---|
| SCHEMBL3090743 | 1.00 | NOS2 (0.37) | NOS2NOS3NOS1BHMTBHMT2 | |
| SCHEMBL3101487 | 0.83 | ALDH1A1 (0.40) | — | |
| SCHEMBL3103370 | 0.83 | FPR2 (0.32) | NOS2NOS3NOS1FOLH1 | |
| SCHEMBL3103364 | 0.83 | FPR2 (0.32) | NOS2NOS3NOS1FOLH1 | |
| SCHEMBL3087332 | 0.82 | METAP2 (0.33) | — | |
| SCHEMBL2983747 | 0.80 | BHMT (0.48) | NOS2NOS3NOS1BHMTBHMT2 | |
| SCHEMBL2983738 | 0.80 | BHMT (0.48) | NOS2NOS3NOS1BHMTBHMT2 | |
| SCHEMBL27743691 | 0.80 | BHMT (0.48) | NOS2NOS3NOS1BHMTBHMT2 | |
| SCHEMBL3098722 | 0.80 | FPR2 (0.43) | FOLH1 | |
| SCHEMBL3091741 | 0.79 | PPARD (0.43) | — |
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-20100247463-A1 | N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE | YU RUEY J | 2010-09-30 | — | — | US | claimed |