Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 12/20 | 0.48 |
| ▸ | GAA | P10253 | 10/20 | 0.48 |
| ▸ | RAB9A | P51151 | 8/20 | 0.48 |
| ▸ | NPC1 | O15118 | 6/20 | 0.48 |
| ▸ | NOX1 | Q9Y5S8 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.43 |
| ▸ | MEN1 | O00255 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23728221 | 0.86 | NOX1 (0.49) | MAPTGAARAB9ANPC1NOX1 | |
| SCHEMBL23728219 | 0.86 | NOX1 (0.49) | MAPTGAARAB9ANPC1NOX1 | |
| SCHEMBL10027943 | 0.85 | NOX1 (0.47) | MAPTGAARAB9ANPC1NOX1 | |
| SCHEMBL27471368 | 0.80 | MAPT (0.42) | MAPTGAARAB9ANPC1NOX1 | |
| SCHEMBL6420581 | 0.80 | NOX1 (0.52) | MAPTGAARAB9ANPC1NOX1 | |
| SCHEMBL1062674 | 0.80 | NOX1 (0.52) | MAPTGAARAB9ANPC1NOX1 | |
| SCHEMBL7494202 | 0.79 | GAA (0.49) | MAPTGAARAB9ANPC1NOX1 | |
| SCHEMBL7493729 | 0.78 | NPC1 (0.44) | MAPTGAARAB9ANPC1KDM4E | |
| SCHEMBL1144416 | 0.77 | NOX1 (0.54) | MAPTGAARAB9ANPC1NOX1 | |
| SCHEMBL5955222 | 0.77 | NOX1 (0.53) | MAPTGAARAB9ANPC1NOX1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0712402-B1 | HYDROISOQUINOLINE DERIVATIVES | SMITHKLINE BEECHAM SPA (IT) | 2002-04-10 | — | — | EP | disclosed |
| US-5731322-A | ADMINISTERING AS ANALGESICS OR IMMUNOMODULATING AND/OR CARDIOVASCULAR AGENTS | SMITHKLINE BEECHAM S.P.A. (IT) | 1998-03-24 | — | — | US | disclosed |
| EP-0712402-A1 | HYDROISOQUINOLINE DERIVATIVES | Smithkline Beecham S.p.A. (IT) | 1996-05-22 | — | — | EP | disclosed |
| WO-1995004734-A1 | HYDROISOQUINOLINE DERIVATIVES | SMITHKLINE BEECHAM FARMACEUTICI S.P.A. (IT) | 1995-02-16 | — | — | WO | disclosed |