Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | KDM5C | P41229 | 1/20 | 0.41 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.41 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | SLC13A5 | Q86YT5 | 4/20 | 0.34 |
| ▸ | ACLY | P53396 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2236854 | 0.98 | ALDH1A1 (0.65) | ALDH1A1KDM4EKDM5CPHF8KDM2A | |
| Water SCHEMBL28826322 | 0.96 | ALDH1A1 (0.62) | ALDH1A1KDM4EKDM5CPHF8KDM2A | |
| Water SCHEMBL28656859 | 0.94 | ALDH1A1 (0.60) | ALDH1A1KDM4EKDM5CPHF8KDM2A | |
| Water SCHEMBL28249027 | 0.94 | ALDH1A1 (0.60) | ALDH1A1KDM4EKDM5CPHF8KDM2A | |
| Biphenyl SCHEMBL27373094 | 0.84 | SLC13A5 (0.55) | ALDH1A1KDM4ELMNASLC13A5CYP2D6 | |
| Citric Acid SCHEMBL25307991 | 0.84 | ALDH1A1 (0.79) | ALDH1A1KDM4ELMNATSHRMAPT | |
| SCHEMBL4377929 | 0.83 | ALDH1A1 (0.44) | ALDH1A1KDM4EKDM5CPHF8KDM2A | |
| Citric Acid SCHEMBL17511199 | 0.83 | ALDH1A1 (0.68) | ALDH1A1KDM4EKDM5CPHF8KDM2A | |
| Citric Acid SCHEMBL27633677 | 0.82 | ALDH1A1 (0.83) | ALDH1A1KDM4ELMNATSHRMAPT | |
| Citric Acid SCHEMBL1649601 | 0.82 | ALDH1A1 (0.94) | ALDH1A1KDM4ELMNATSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-1829683-B | Mildronate, preparation method thereof and pharmaceutical composition based on mildronate | UNION GREEN DAS | 2010-05-12 | — | — | CN | disclosed |
| CN-1829683-A | Mildronate, preparation method thereof and pharmaceutical composition based on mildronate | GRINDEKS JSC (LV) | 2006-09-06 | — | — | CN | disclosed |