Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.38 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20292623 | 0.78 | KDM4E (0.44) | KDM4EALDH1A1POLBMAPTTSHR | |
| SCHEMBL28683978 | 0.78 | KDM4E (0.62) | KDM4EALDH1A1POLBMAPTCACNA2D1 | |
| SCHEMBL3939571 | 0.78 | ALDH1A1 (0.48) | KDM4EALDH1A1POLBMAPTTSHR | |
| SCHEMBL4856952 | 0.78 | PLAU (0.46) | KDM4EALDH1A1POLBMAPTTSHR | |
| SCHEMBL13723931 | 0.78 | CYP1A2 (0.48) | KDM4EALDH1A1POLBTSHRCACNA2D1 | |
| SCHEMBL27314484 | 0.76 | KDM4E (0.47) | KDM4EALDH1A1POLBMAPTTSHR | |
| SCHEMBL9849240 | 0.75 | POLB (0.39) | KDM4EALDH1A1POLBLMNACACNA2D1 | |
| SCHEMBL304561 | 0.74 | — | — | |
| SCHEMBL51697 | 0.74 | IDO1 (0.46) | KDM4EALDH1A1MAPTTSHRLMNA | |
| SCHEMBL29478202 | 0.74 | IDO1 (0.46) | KDM4EALDH1A1MAPTTSHRLMNA |
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-0435235-B1 | Isoquinoline derivatives and salts thereof as protease inhibitors. | SNOW BRAND MILK PRODUCTS CO LTD (JP) | 1995-03-08 | — | — | EP | disclosed |
| EP-0435235-A1 | Isoquinoline derivatives and salts thereof as protease inhibitors. | SNOW BRAND MILK PRODUCTS CO., LTD. (JP) | 1991-07-03 | — | — | EP | disclosed |