Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.34 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | TTR | P02766 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | RARB | P10826 | 1/20 | 0.34 |
| ▸ | COMT | P21964 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10950427 | 0.90 | ALDH1A1 (0.37) | ALDH1A1HPGDRAB9ALMNAPTGS2 | |
| SCHEMBL10950546 | 0.87 | L3MBTL1 (0.38) | ALDH1A1PTGS2PDE3ASMN1; SMN2KMT2A | |
| SCHEMBL10876558 | 0.81 | — | — | |
| SCHEMBL10949689 | 0.80 | MAOB (0.34) | ALDH1A1HPGDRAB9ALMNASMN1; SMN2 | |
| SCHEMBL10879461 | 0.79 | MAPT (0.38) | ALDH1A1HPGDRAB9ALMNASMN1; SMN2 | |
| SCHEMBL10949638 | 0.70 | MAPT (0.43) | ALDH1A1HPGDRAB9ALMNASMN1; SMN2 | |
| SCHEMBL10876564 | 0.69 | — | — | |
| SCHEMBL10876992 | 0.69 | PTGS2 (0.38) | PTGS2MAPTPTGS1 | |
| SCHEMBL10877142 | 0.68 | ALDH1A1 (0.37) | ALDH1A1HPGDRAB9ALMNAPTGS2 | |
| SCHEMBL10878281 | 0.68 | MAPT (0.44) | ALDH1A1HPGDRAB9ALMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4526981-A | [1,2-Dihydro-4(5)-acyl-2-oxo-2H-imidazol-4(5)-yl] methyl nitrates | MERRELL DOW PHARMACEUTICALS INC. (US) | 1985-07-02 | — | — | US | disclosed |