Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSPO | P30536 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KLK1 | P06870 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7704872 | 0.92 | HSD17B2 (0.38) | ALDH1A1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7708189 | 0.91 | HDAC3 (0.37) | ALDH1A1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7711366 | 0.91 | HDAC1 (0.37) | ALDH1A1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7704910 | 0.90 | HDAC1 (0.45) | ALDH1A1NPSR1HDAC3HDAC1HDAC2 | |
| SCHEMBL7708353 | 0.89 | GRM2 (0.37) | ALDH1A1NPSR1HDAC3HDAC1HDAC2 | |
| SCHEMBL7704965 | 0.89 | HDAC3 (0.36) | ALDH1A1NPSR1HDAC3HDAC1HDAC2 | |
| SCHEMBL7711328 | 0.89 | HDAC3 (0.35) | HDAC3HDAC1HDAC2NCOR2L3MBTL1 | |
| SCHEMBL7713435 | 0.87 | HDAC1 (0.34) | HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7710748 | 0.87 | CA2 (0.35) | NPSR1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7711458 | 0.86 | HDAC3 (0.33) | HDAC3HDAC1HDAC2NCOR2TSHR |
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 |