Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20496961 | 0.84 | NOS1 (0.40) | LTA4HNOS1NOS3NOS2 | |
| SCHEMBL8616170 | 0.82 | NOS2 (0.46) | NOS1NOS3NOS2 | |
| SCHEMBL15327783 | 0.82 | LTA4H (0.48) | L3MBTL1LTA4H | |
| SCHEMBL2035742 | 0.78 | GRIK1 (0.49) | — | |
| SCHEMBL1309368 | 0.78 | GSR (0.50) | LTA4HNOS1 | |
| SCHEMBL6881510 | 0.78 | TDP1 (0.46) | LTA4HNOS1NOS3NOS2 | |
| SCHEMBL1309450 | 0.78 | GSR (0.50) | LTA4HNOS1 | |
| SCHEMBL2131918 | 0.78 | GSR (0.50) | LTA4HNOS1 | |
| SCHEMBL1310240 | 0.78 | GSR (0.50) | LTA4HNOS1 | |
| SCHEMBL5287476 | 0.78 | HDAC6 (0.39) | HDAC1HDAC2HDAC6CA14L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2389356-B1 | NOVEL AZAPEPTIDE OR AZAPEPTIDOMIMETIC COMPOUNDS INHIBITING BCRP AND/OR P-GP | UNIV CLAUDE BERNARD LYON (FR) | 2013-10-23 | — | — | EP | disclosed |