Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PTK2 | Q05397 | 3/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9749161 | 0.98 | APEX1 (0.39) | APEX1ALDH1A1HSD17B10GAAPTK2 | |
| SCHEMBL9749437 | 0.95 | APEX1 (0.41) | APEX1ALDH1A1HSD17B10GAAPTK2 | |
| SCHEMBL9748936 | 0.89 | APEX1 (0.51) | APEX1ALDH1A1HSD17B10GAATSHR | |
| SCHEMBL9749606 | 0.73 | ALDH1A1 (0.44) | APEX1ALDH1A1HSD17B10GAAPTK2 | |
| SCHEMBL10690778 | 0.72 | APEX1 (0.42) | APEX1ALDH1A1HSD17B10GAAPTK2 | |
| SCHEMBL10685590 | 0.71 | APEX1 (0.41) | APEX1ALDH1A1HSD17B10GAAPTK2 | |
| SCHEMBL10968557 | 0.70 | APEX1 (0.47) | APEX1ALDH1A1HSD17B10GAATSHR | |
| SCHEMBL3455482 | 0.70 | ALDH1A1 (0.52) | APEX1ALDH1A1HSD17B10TSHRPOLB | |
| SCHEMBL9749375 | 0.68 | ALDH1A1 (0.45) | APEX1ALDH1A1HSD17B10GAATSHR | |
| SCHEMBL10969470 | 0.68 | SMN1; SMN2 (0.54) | ALDH1A1HSD17B10GAATSHRPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0194572-B1 | HETEROCYCLIC SULFIDES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-01-02 | — | — | EP | disclosed |