Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.90 |
| ▸ | POLB | P06746 | 1/20 | 0.90 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | TDP2 | O95551 | 2/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | CASP9 | P55211 | 1/20 | 0.46 |
| ▸ | CASP6 | P55212 | 1/20 | 0.46 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.46 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL23572021 | 0.86 | ALDH1A1 (0.73) | ALDH1A1POLBLMNAALOX12NPSR1 | |
| SCHEMBL18191781 | 0.77 | ALDH1A1 (0.59) | ALDH1A1POLBNPSR1MAPK1TSHR | |
| SCHEMBL18191774 | 0.75 | SIGMAR1 (0.59) | ALDH1A1POLBLMNAMAPTTSHR | |
| SCHEMBL29964356 | 0.74 | NPSR1 (0.62) | ALDH1A1POLBLMNANPSR1MAPT | |
| SCHEMBL4842012 | 0.74 | NPSR1 (0.62) | ALDH1A1POLBLMNANPSR1MAPT | |
| SCHEMBL15210711 | 0.73 | ALDH1A1 (0.51) | ALDH1A1POLBLMNAALOX12MAPT | |
| SCHEMBL6980706 | 0.72 | ALDH1A1 (0.59) | ALDH1A1POLBLMNAALOX12NPSR1 | |
| SCHEMBL11663391 | 0.71 | ALDH1A1 (0.54) | ALDH1A1POLBLMNAALOX12NPSR1 | |
| SCHEMBL30711813 | 0.71 | ALDH1A1 (0.53) | ALDH1A1POLBLMNAMAPTTSHR | |
| SCHEMBL4838949 | 0.70 | ALDH1A1 (0.54) | ALDH1A1POLBLMNAALOX12NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993014086-A1 | SUBSTITUTED 1-ISOQUINOLONE DERIVATIVES AS ANGIOTENSIN II ANTAGONISTS | SYNTEX (U.S.A.) INC. (US) | 1993-07-22 | — | — | WO | disclosed |