Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | THRA | P10827 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | LIPE | Q05469 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9497903 | 0.78 | NPC1 (0.42) | BCHEACHEALDH1A1KDM4E | |
| SCHEMBL9499554 | 0.76 | BCHE (0.42) | BCHEACHEALDH1A1KDM4E | |
| SCHEMBL15054606 | 0.76 | L3MBTL1 (0.43) | L3MBTL1ALDH1A1TSHRKDM4ETP53 | |
| SCHEMBL15054605 | 0.72 | L3MBTL1 (0.45) | L3MBTL1ALDH1A1TSHRKDM4ETP53 | |
| SCHEMBL9329945 | 0.70 | SSTR4 (0.57) | — | |
| SCHEMBL7837568 | 0.69 | L3MBTL1 (0.51) | L3MBTL1ALDH1A1KDM4ETP53GLA | |
| SCHEMBL25205403 | 0.69 | BCHE (0.40) | L3MBTL1BCHEACHEALDH1A1MAPT | |
| SCHEMBL28674397 | 0.69 | ALDH1A1 (0.39) | BCHEACHEALDH1A1TSHRKDM4E | |
| SCHEMBL9345057 | 0.69 | CNR1 (0.39) | MAPTHTTLIPE | |
| SCHEMBL2015296 | 0.69 | ALDH1A1 (0.46) | BCHEACHEALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5280031-A | Cyclic azaaliphatic compounds with a nitroxy function, processes for the preparation thereof and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1994-01-18 | — | — | US | disclosed |
| US-5030641-A | Treatment of angina pectoris, hypotensive agents | BOEHRINGER MANNHEIM GMBH (DE) | 1991-07-09 | — | — | US | disclosed |