Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | RXRB | P28702 | 1/20 | 0.44 |
| ▸ | RXRG | P48443 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 14/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL9055061 | 0.85 | S1PR1 (0.48) | RXRARXRBRXRGS1PR1 | |
| Hydrochloric Acid SCHEMBL20509927 | 0.79 | RXRA (0.50) | RXRARXRBRXRGITGB3ITGA2B | |
| SCHEMBL9056558 | 0.76 | RXRA (0.42) | RXRARXRBRXRGITGB3ITGA2B | |
| SCHEMBL20510025 | 0.72 | PLAU (0.53) | RXRARXRBRXRGITGB3ITGA2B | |
| SCHEMBL8560143 | 0.72 | RXRA (0.40) | RXRARXRBRXRGITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL8564229 | 0.71 | MAPK9 (0.38) | RXRARXRBRXRGITGB3ITGA2B | |
| SCHEMBL9053431 | 0.71 | LMNA (0.38) | LMNAFFAR4 | |
| SCHEMBL9053277 | 0.71 | LMNA (0.43) | RXRARXRBRXRGLMNAFFAR4 | |
| SCHEMBL9058459 | 0.71 | DVL1 (0.39) | — | |
| SCHEMBL9053434 | 0.71 | EIF4E (0.39) | LMNAFFAR4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996004271-A1 | CONDENSED AZEPINE DERIVATIVES, DRUGS CONTAINING THESE COMPOUNDS AND METHODS FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1996-02-15 | — | — | WO | disclosed |