Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.38 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9749643 | 0.95 | APEX1 (0.40) | APEX1ALDH1A1HSD17B10GAACSNK2A2 | |
| SCHEMBL9749161 | 0.94 | APEX1 (0.39) | APEX1ALDH1A1HSD17B10GAATSHR | |
| SCHEMBL9748936 | 0.90 | APEX1 (0.51) | APEX1ALDH1A1HSD17B10GAACSNK2A2 | |
| SCHEMBL10968557 | 0.74 | APEX1 (0.47) | APEX1ALDH1A1HSD17B10GAACSNK2A2 | |
| SCHEMBL9749375 | 0.72 | ALDH1A1 (0.45) | APEX1ALDH1A1HSD17B10GAACSNK2A2 | |
| SCHEMBL10969470 | 0.72 | SMN1; SMN2 (0.54) | ALDH1A1HSD17B10GAATSHRSMN1; SMN2 | |
| Tiprotimod SCHEMBL1684013 | 0.71 | APEX1 (0.44) | APEX1ALDH1A1HSD17B10GAACSNK2A2 | |
| SCHEMBL9749776 | 0.71 | APEX1 (0.44) | APEX1ALDH1A1HSD17B10GAACSNK2A2 | |
| SCHEMBL2210099 | 0.71 | ALDH1A1 (0.44) | APEX1ALDH1A1HSD17B10GAATSHR | |
| SCHEMBL10685559 | 0.71 | APEX1 (0.78) | APEX1ALDH1A1HSD17B10GAACSNK2A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0194572-B1 | HETEROCYCLIC SULFIDES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-01-02 | — | — | EP | disclosed |
| EP-0194572-A1 | Heterocyclic sulfides, process for their preparation and Medicaments containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1986-09-17 | — | — | EP | disclosed |