Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CNR2 | P34972 | 3/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 3/20 | 0.41 |
| ▸ | CES1 | P23141 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.40 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28124829 | 0.86 | TSHR (0.54) | ALDH1A1SMN1; SMN2TP53MAPTGAA | |
| SCHEMBL29384309 | 0.83 | MAPT (0.77) | ALDH1A1SMN1; SMN2TP53MAPTGAA | |
| SCHEMBL501813 | 0.83 | MAPT (0.77) | ALDH1A1SMN1; SMN2TP53MAPTGAA | |
| SCHEMBL27287630 | 0.83 | TSHR (0.50) | ALDH1A1SMN1; SMN2TP53MAPTGAA | |
| Benzophenone SCHEMBL27403393 | 0.82 | MAPT (0.74) | ALDH1A1SMN1; SMN2TP53MAPTGAA | |
| Benzophenone SCHEMBL28171686 | 0.82 | ALDH1A1 (0.54) | ALDH1A1TSHRCNR2CES2CES1 | |
| SCHEMBL28351687 | 0.80 | MAPT (0.78) | ALDH1A1SMN1; SMN2TP53MAPTGAA | |
| SCHEMBL28857084 | 0.80 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2TP53MAPTGAA | |
| Ether SCHEMBL28985206 | 0.80 | MAPT (0.61) | ALDH1A1SMN1; SMN2TP53MAPTGAA | |
| Urea SCHEMBL28233566 | 0.79 | MAPT (0.69) | ALDH1A1SMN1; SMN2TP53MAPTGAA |
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-101784520-B | Novel malonic acid sulfonamide derivative and pharmaceutical use thereof | MITSUBISHI TANABE PHARMA CORP | 2014-07-02 | — | — | CN | disclosed |
| CN-101784520-A | Novel malonic acid sulfonamide derivative and pharmaceutical use thereof | MITSUBISHI TANABE PHARMA CORP | 2010-07-21 | — | — | CN | disclosed |