Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | CETP | P11597 | 9/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.43 |
| ▸ | PIK3C3 | Q8NEB9 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL13010992 | 0.90 | MGLL (0.43) | HDAC1HDAC6HDAC8CETPHDAC5 | |
| SCHEMBL27778845 | 0.90 | HDAC1 (0.44) | HDAC1HDAC6HDAC8NOTUMCETP | |
| SCHEMBL13011721 | 0.87 | CETP (0.41) | HDAC1HDAC6HDAC8CETPHDAC5 | |
| SCHEMBL14155611 | 0.86 | HDAC1 (0.55) | HDAC1HDAC6HDAC8HDAC5HCRTR1 | |
| SCHEMBL2691178 | 0.83 | TNKS (0.49) | HDAC1HDAC6HDAC8HDAC5HCRTR1 | |
| SCHEMBL2693640 | 0.83 | TNKS (0.49) | HDAC1HDAC6HDAC8HDAC5HCRTR1 | |
| SCHEMBL2691174 | 0.83 | TNKS (0.49) | HDAC1HDAC6HDAC8HDAC5HCRTR1 | |
| SCHEMBL3739324 | 0.78 | HDAC6 (0.54) | HDAC1HDAC6HDAC8NOTUMHDAC5 | |
| SCHEMBL27778619 | 0.78 | CETP (0.42) | HDAC1HDAC6HDAC8CETPPIK3C3 | |
| SCHEMBL3586830 | 0.73 | ALDH1A1 (0.47) | DRD2 |
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-2009131814-A2 | 1,5-DIPHENYL-PYRROLIDIN-2-ONE COMPOUNDS AS CB-1 LIGANDS | ELI LILLY AND COMPANY (US) | 2009-10-29 | — | — | WO | disclosed |