Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 7/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 4/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9591311 | 1.00 | TDP1 (0.43) | TDP1GPR119CNR2CRBNNR5A1 | |
| SCHEMBL9590846 | 1.00 | TDP1 (0.43) | TDP1GPR119CNR2CRBNNR5A1 | |
| SCHEMBL9349567 | 1.00 | TDP1 (0.43) | TDP1GPR119CNR2CRBNNR5A1 | |
| SCHEMBL9346319 | 1.00 | TDP1 (0.43) | TDP1GPR119CNR2CRBNNR5A1 | |
| SCHEMBL9345318 | 1.00 | TDP1 (0.43) | TDP1GPR119CNR2CRBNNR5A1 | |
| SCHEMBL9188863 | 0.99 | TDP1 (0.44) | TDP1GPR119CNR2CRBNNR5A1 | |
| SCHEMBL9188856 | 0.99 | TDP1 (0.44) | TDP1GPR119CNR2CRBNNR5A1 | |
| SCHEMBL9591878 | 0.95 | TDP1 (0.42) | TDP1GPR119CNR2CRBNITGB3 | |
| SCHEMBL9184993 | 0.95 | TDP1 (0.42) | TDP1GPR119CNR2CRBNITGB3 | |
| SCHEMBL9184989 | 0.95 | TDP1 (0.42) | TDP1GPR119CNR2CRBNITGB3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5238600-A | IBIMETHYLENOXY CONTAINING LIQUID CRYSTAL COMPOUNDS | HOFFMANN-LA ROCHE INC. (US) | 1993-08-24 | — | — | US | disclosed |