Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 5/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 4/20 | 0.31 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10949682 | 0.91 | ESR2 (0.35) | MAOBALDH1A1POLBLMNAGAA | |
| SCHEMBL10950427 | 0.89 | ALDH1A1 (0.37) | MAOBALDH1A1LMNAGAAKMT2A | |
| SCHEMBL10921382 | 0.81 | PTPN1 (0.39) | ALDH1A1POLBLMNAGAAKMT2A | |
| SCHEMBL10952285 | 0.78 | PTGS2 (0.41) | ALDH1A1LMNAGAASMN1; SMN2MAPT | |
| SCHEMBL10950546 | 0.76 | L3MBTL1 (0.38) | ALDH1A1GAAKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL10878281 | 0.68 | MAPT (0.44) | ALDH1A1LMNAGAAKMT2AMEN1 | |
| SCHEMBL10949643 | 0.68 | ALDH1A1 (0.41) | ALDH1A1LMNAGAAKMT2AMEN1 | |
| SCHEMBL10877790 | 0.67 | MAPT (0.42) | ALDH1A1LMNAGAAKMT2AMEN1 | |
| SCHEMBL10875629 | 0.62 | MAPT (0.45) | ALDH1A1LMNAGAAKMT2AMEN1 | |
| SCHEMBL238259 | 0.59 | LTA4H (0.73) | ALDH1A1LMNASMN1; SMN2NPC1TP53 |
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 |