Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | ACHE | P22303 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | PTGES | O14684 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11667483 | 0.83 | POLB (0.52) | ALDH1A1SMN1; SMN2ACHEPOLBKDM4E | |
| SCHEMBL13261464 | 0.81 | SMN1; SMN2 (0.52) | ALDH1A1SMN1; SMN2POLBKDM4ENPC1 | |
| SCHEMBL5566351 | 0.80 | ACHE (0.52) | ALDH1A1SMN1; SMN2ACHEPOLBKDM4E | |
| SCHEMBL27925402 | 0.78 | MAOB (0.45) | ACHEKDM4ERAB9ABCHEHSD17B10 | |
| SCHEMBL6890994 | 0.78 | POLB (0.54) | ALDH1A1SMN1; SMN2POLBKDM4ENPC1 | |
| SCHEMBL3896033 | 0.77 | SMN1; SMN2 (0.55) | ALDH1A1SMN1; SMN2POLBKDM4ENPC1 | |
| SCHEMBL11653596 | 0.77 | SMN1; SMN2 (0.58) | ALDH1A1SMN1; SMN2POLBKDM4ENPC1 | |
| SCHEMBL4952423 | 0.77 | ACHE (0.60) | ALDH1A1SMN1; SMN2ACHEPOLBKDM4E | |
| SCHEMBL27775591 | 0.76 | ACHE (0.43) | ALDH1A1SMN1; SMN2ACHEKDM4ENPC1 | |
| SCHEMBL27741407 | 0.76 | ACHE (0.50) | ALDH1A1ACHEBCHE |
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 |
|---|---|---|---|---|---|---|---|
| CN-102056894-A | Homocysteine synthase inhibitor | MITSUBISHI TANABE PHARMA CORP | 2011-05-11 | — | — | CN | disclosed |