Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 6/20 | 0.41 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9426107 | 0.84 | PSIP1 (0.56) | HSD11B1PSIP1MEN1KMT2ARCE1 | |
| SCHEMBL7724605 | 0.84 | PSIP1 (0.56) | HSD11B1PSIP1MEN1KMT2ARCE1 | |
| Isophthalic Acid SCHEMBL28137487 | 0.81 | HSD11B1 (0.45) | HSD11B1MEN1KMT2ATSHRALDH1A1 | |
| Propylene Glycol SCHEMBL28803562 | 0.77 | TSHR (0.47) | MEN1KMT2ATSHRSMN1; SMN2ALDH1A1 | |
| Isopropyl Alcohol SCHEMBL28791730 | 0.77 | TSHR (0.53) | MEN1KMT2ATSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL27469215 | 0.76 | TSHR (0.46) | MEN1KMT2ATSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL27735944 | 0.76 | TSHR (0.46) | MEN1KMT2ATSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL27318012 | 0.75 | ALDH1A1 (0.47) | MEN1KMT2ATSHRALDH1A1CYP1A2 | |
| Isobutane SCHEMBL27746314 | 0.75 | TSHR (0.55) | MEN1KMT2ATSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL1020225 | 0.75 | ALDH1A1 (0.44) | HSD11B1MEN1KMT2AALDH1A1 |
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-106631926-A | Method for selectively compounding aryl methyl sulphone and belta-hydroxy sulphone derivative | 华南理工大学 | 2017-05-10 | — | — | CN | disclosed |