Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.31 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.31 |
| ▸ | BACE1 | P56817 | 4/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 2/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL7708180 | 0.87 | HTT (0.34) | L3MBTL1ALDH1A1LMNAPOLBTRPM8 | |
| SCHEMBL7704961 | 0.83 | HDAC3 (0.33) | HTR2CSLC6A4HDAC3HDAC1HDAC2 | |
| SCHEMBL5188384 | 0.81 | LMNA (0.31) | L3MBTL1ALDH1A1LMNA | |
| SCHEMBL7088859 | 0.80 | PARP1 (0.37) | HTR2CSLC6A4HDAC3HDAC1HDAC2 | |
| SCHEMBL7704922 | 0.80 | PARP1 (0.48) | HDAC3HDAC1HDAC2NCOR2L3MBTL1 | |
| SCHEMBL6302740 | 0.79 | HDAC3 (0.43) | HTR2CSLC6A4HDAC3HDAC1HDAC2 | |
| SCHEMBL5476931 | 0.77 | HDAC1 (0.36) | HTR2CSLC6A4HDAC3HDAC1HDAC2 | |
| SCHEMBL7704912 | 0.76 | ALDH1A1 (0.45) | ALDH1A1LMNAHSD17B10 | |
| SCHEMBL7710216 | 0.75 | HSD17B10 (0.35) | HTR2CSLC6A4HDAC3HDAC1HDAC2 | |
| SCHEMBL5482158 | 0.73 | KDM4E (0.30) | ALDH1A1 |
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-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |