Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.32 |
| ▸ | CDC42BPB | Q9Y5S2 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.31 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9455863 | 0.84 | TSHR (0.34) | TSHRPDE10AALDH1A1MAPK1HPGD | |
| SCHEMBL9455821 | 0.79 | TSHR (0.39) | TSHRSMN1; SMN2ALDH1A1POLBMAPK1 | |
| SCHEMBL9455858 | 0.73 | ROCK2 (0.39) | TSHRPDE10ASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL9456469 | 0.71 | ROCK2 (0.37) | TSHRPDE10ASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL10522829 | 0.70 | OPRK1 (0.43) | TSHRSMN1; SMN2ALDH1A1NPC1GAA | |
| SCHEMBL10567632 | 0.70 | LMNA (0.48) | TSHRSMN1; SMN2ALDH1A1MAPK1NPC1 | |
| SCHEMBL10565483 | 0.68 | LMNA (0.45) | TSHRSMN1; SMN2ALDH1A1MAPK1NPC1 | |
| SCHEMBL9455937 | 0.68 | KDM4E (0.42) | TSHRSMN1; SMN2ALDH1A1MAPK1HPGD | |
| SCHEMBL191418 | 0.67 | AGXT (0.45) | TSHRPDE10AALDH1A1HPGDKMT2A | |
| SCHEMBL9456475 | 0.66 | ALDH1A1 (0.39) | TSHRSMN1; SMN2ALDH1A1MAPK1NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5250527-A | Enzyme inhibitors; administering to reduce gastric acid secretion | SMITHKLINE & FRENCH LABORATORIES LIMITED (GB) | 1993-10-05 | — | — | US | disclosed |
| EP-0184322-B1 | BENZIMIDAZOLES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1989-12-20 | — | — | EP | disclosed |
| EP-0184322-A1 | Benzimidazoles | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1986-06-11 | — | — | EP | disclosed |