Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNT1 | Q5JUK3 | 1/20 | 0.43 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL28210751 | 0.84 | FKBP1A (0.42) | FKBP1AKMT2AGLALMNAALDH1A1 | |
| SCHEMBL28211341 | 0.81 | KCNT1 (0.53) | KCNT1FKBP1AKMT2AGLALMNA | |
| SCHEMBL28858446 | 0.80 | ALDH1A1 (0.50) | FKBP1AKMT2AGLALMNACYP2D6 | |
| SCHEMBL30916938 | 0.77 | KMT2A (0.48) | FKBP1AKMT2AGLACYP1A2ALDH1A1 | |
| SCHEMBL29978636 | 0.77 | KMT2A (0.48) | FKBP1AKMT2AGLACYP3A4CYP2D6 | |
| SCHEMBL25168200 | 0.76 | FKBP1A (0.49) | FKBP1AKMT2AGLALMNACYP1A2 | |
| Hydrochloric Acid SCHEMBL28210785 | 0.76 | KMT2A (0.47) | FKBP1AKMT2AGLACYP3A4CYP2D6 | |
| SCHEMBL16707644 | 0.70 | FKBP1A (0.43) | FKBP1AKMT2AGLALMNAALDH1A1 | |
| SCHEMBL18424952 | 0.70 | TGM2 (0.49) | FKBP1ACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL16720320 | 0.68 | ALDH1A1 (0.47) | KMT2ALMNAALDH1A1SMN1; SMN2MAPT |
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-107980040-A | 1,3,4- oxadiazoles sulfamide derivative as 6 inhibitor of histone deacetylase enzyme and the medical composition containing it | 株式会社钟根堂 | 2018-05-01 | — | — | CN | disclosed |