Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 14/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | PTK2 | Q05397 | 1/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8558943 | 0.79 | DRD2 (0.32) | — | |
| Hydrochloric Acid SCHEMBL7394715 | 0.74 | ITGB3 (0.39) | — | |
| Hydrochloric Acid SCHEMBL8566645 | 0.73 | ACHE (0.40) | — | |
| SCHEMBL8566561 | 0.73 | ESR1 (0.38) | ESR2 | |
| SCHEMBL8566564 | 0.73 | ESR1 (0.38) | ESR2 | |
| SCHEMBL8562233 | 0.73 | ESR1 (0.39) | GPR119ESR2 | |
| SCHEMBL8562237 | 0.73 | ESR1 (0.39) | GPR119ESR2 | |
| SCHEMBL7478828 | 0.73 | ESR1 (0.38) | ESR2 | |
| SCHEMBL7478822 | 0.73 | ESR1 (0.38) | ESR2 | |
| SCHEMBL9054096 | 0.73 | HDAC4 (0.42) | NPC1RAB9AGPR119 |
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-0612741-B1 | Cyclic derivatives, medicaments containing them and process for their preparation | THOMAE GMBH DR K (DE) | 1998-06-10 | — | — | EP | disclosed |
| EP-0612741-A1 | Cyclic derivatives, medicaments containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1994-08-31 | — | — | EP | disclosed |