Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.53 |
| ▸ | IL6 | P05231 | 2/20 | 0.47 |
| ▸ | STAT3 | P40763 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPSE | Q9Y251 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.42 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2437918 | 0.89 | NPC1 (0.56) | HDAC6IL6STAT3GAAHPSE | |
| SCHEMBL11640477 | 0.88 | CSNK1D (0.49) | IL6STAT3GAAMAPTHPSE | |
| SCHEMBL11637058 | 0.85 | PSEN1 (0.46) | IL6STAT3GAAMAPTHPSE | |
| SCHEMBL31430448 | 0.84 | GAA (0.55) | HDAC6IL6STAT3GAAMAPT | |
| SCHEMBL14371695 | 0.82 | GAA (0.50) | GAAMAPTHPSEALDH1A1CSNK1D | |
| SCHEMBL14626860 | 0.81 | NPC1 (0.54) | HDAC6IL6STAT3GAANPC1 | |
| SCHEMBL6616110 | 0.81 | HDAC6 (0.62) | HDAC6IL6STAT3GAAUSP2 | |
| SCHEMBL2429466 | 0.81 | ITGA4 (0.56) | IL6STAT3GAAMAPTNPC1 | |
| SCHEMBL7659834 | 0.80 | KDM4E (0.52) | HDAC6IL6STAT3GAAUSP2 | |
| SCHEMBL7429665 | 0.80 | NPC1 (0.53) | HDAC6IL6STAT3GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1392306-A1 | SUBSTITUTED TETRAHYDROISOQUINOLINES FOR USE IN THE TREATMENT OF INFLAMMATORY DISEASES | Aventis Pharma Limited (GB) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002098426-A1 | SUBSTITUTED TETRAHYDROISOQUINOLINES FOR USE IN THE TREATMENT OF INFLAMMATORY DISEASES | AVENTIS PHARMA LIMTIED (GB) | 2002-12-12 | — | — | WO | disclosed |