Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | INMT | O95050 | 1/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| Acetone SCHEMBL25437214 | 0.89 | TSHR (0.55) | TSHRINMTPIK3CDKMT2ALMNA | |
| Acetic Acid SCHEMBL5493148 | 0.87 | INMT (0.55) | TSHRINMTPIK3CDKMT2ALMNA | |
| Acetamide SCHEMBL1694656 | 0.85 | TSHR (0.61) | TSHRINMTPIK3CDKMT2ALMNA | |
| SCHEMBL18635 | 0.84 | — | — | |
| SCHEMBL27958225 | 0.84 | PIK3CD (0.59) | TSHRINMTPIK3CDKMT2ALMNA | |
| Alcohol SCHEMBL5284370 | 0.83 | PIK3CD (0.53) | TSHRINMTPIK3CDKMT2ALMNA | |
| SCHEMBL30679684 | 0.82 | — | — | |
| Water SCHEMBL6122968 | 0.82 | PIK3CD (0.57) | TSHRINMTPIK3CDKMT2ALMNA | |
| Arsenic SCHEMBL28843817 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL23248746 | 0.82 | — | — |
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-2030973-A1 | Process for preparing 2-sulfinyl-1H-benzimidazoles | KRKA, tovarna zdravil, d.d., Novo mesto (SI) | 2009-03-04 | — | — | EP | disclosed |