Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.35 |
| ▸ | NOS1 | P29475 | 2/20 | 0.35 |
| ▸ | NOS2 | P35228 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10310085 | 0.77 | NOS3 (0.38) | NOS3NOS1NOS2PARP1KDM4E | |
| SCHEMBL19831176 | 0.77 | RXRA (0.32) | NOS3NOS1NOS2PARP1KDM4E | |
| SCHEMBL25759811 | 0.76 | NOS3 (0.36) | NOS3NOS1NOS2PARP1KDM4E | |
| SCHEMBL9128305 | 0.74 | NOS3 (0.35) | NOS3NOS1NOS2PARP1KDM4E | |
| SCHEMBL10268101 | 0.74 | NOS3 (0.56) | NOS3NOS1NOS2PARP1 | |
| SCHEMBL9970964 | 0.74 | NOS3 (0.35) | NOS3NOS1NOS2PARP1KDM4E | |
| SCHEMBL2597202 | 0.74 | NOS3 (0.35) | NOS3NOS1NOS2PARP1 | |
| SCHEMBL8631001 | 0.74 | PTGS2 (0.36) | NOS3NOS1NOS2RAPGEF4 | |
| SCHEMBL23626192 | 0.72 | — | — | |
| SCHEMBL2714235 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170073460-A1 | POLYETHER KETONE COMPOUND | AJINOMOTO CO., INC. (JP) | 2017-03-16 | — | — | US | disclosed |
| WO-2016079712-A1 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2016-05-26 | — | — | WO | disclosed |