Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9344169 | 0.94 | TSHR (0.39) | MAPK1EPHX2L3MBTL1GAAALDH1A1 | |
| SCHEMBL9344103 | 0.84 | ALDH1A1 (0.42) | EPHX2TDP1GAAALDH1A1NPC1 | |
| SCHEMBL9333191 | 0.82 | EPHX1 (0.43) | MEN1KMT2ADRD2HTR2ALMNA | |
| SCHEMBL9329950 | 0.82 | EPHX1 (0.43) | MEN1KMT2ADRD2HTR2ALMNA | |
| SCHEMBL13783322 | 0.82 | MAPK1 (0.53) | MAPK1EPHX2L3MBTL1TDP1GAA | |
| SCHEMBL9348740 | 0.80 | DRD2 (0.40) | MAPK1EPHX2L3MBTL1CTDSP1TDP1 | |
| SCHEMBL9346184 | 0.80 | EPHX1 (0.41) | EPHX2GAAKMT2ASMN1; SMN2 | |
| SCHEMBL9344988 | 0.78 | EPHX2 (0.40) | MAPK1EPHX2L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL20159607 | 0.78 | L3MBTL1 (0.51) | MAPK1EPHX2L3MBTL1GAAALDH1A1 | |
| SCHEMBL9348981 | 0.77 | LMNA (0.43) | ALDH1A1KMT2ADRD2HTR2ADRD3 |
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 |