Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | SI | P14410 | 1/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Acetic Acid Methyl Ester SCHEMBL27818121 | 0.83 | ALDH1A1 (0.46) | GAALMNAALDH1A1KDM4EMAPT | |
| SCHEMBL14203260 | 0.80 | KMT2A (0.48) | GAALMNAALDH1A1KDM4EMAPT | |
| SCHEMBL5992538 | 0.79 | PTGS1 (0.44) | GAALMNAALDH1A1MAPTHSP90AB1 | |
| SCHEMBL2926152 | 0.78 | HSP90AB1 (0.66) | GAAALDH1A1KDM4EMAPTHSP90AB1 | |
| SCHEMBL36529 | 0.76 | ALDH1A1 (0.65) | GAALMNAALDH1A1KDM4EMAPT | |
| SCHEMBL27800318 | 0.76 | ALDH1A1 (0.65) | GAALMNAALDH1A1KDM4EMAPT | |
| Phosphine SCHEMBL28030392 | 0.76 | ALDH1A1 (0.41) | GAALMNAALDH1A1KDM4EMAPT | |
| SCHEMBL7860044 | 0.76 | POLB (0.40) | GAALMNAALDH1A1KDM4EMAPT | |
| SCHEMBL769278 | 0.75 | GAA (0.48) | GAALMNAALDH1A1KDM4EMAPT | |
| Oxalic Acid SCHEMBL27550942 | 0.75 | ALDH1A1 (0.52) | GAALMNAALDH1A1KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| JP-54046750-A | — | — | None | — | — | JP | disclosed |
| JP-S5446750-A | PREPARATION OF AQUEOUS SOLUTION OF SODIUM SALT OF 4- METHOXYCARBONYL-5, 5-DIMETHYLCYCLOHEXANE-1, 3-DIONE-ENOL | NIPPON SODA CO LTD | 1979-04-12 | — | — | JP | disclosed |