Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.45 |
| ▸ | KIF11 | P52732 | 2/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.36 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL376513 | 1.00 | CYP2A6 (0.45) | CYP2A6KIF11BACE1MTNR1AMTNR1B | |
| SCHEMBL378037 | 0.87 | CYP2A6 (0.47) | CYP2A6KIF11BACE1MTNR1AMTNR1B | |
| SCHEMBL9009152 | 0.80 | CYP2A6 (0.41) | CYP2A6KIF11BACE1MTNR1AMTNR1B | |
| SCHEMBL2648417 | 0.79 | SIRT1 (0.47) | CYP2A6KIF11BACE1MTNR1AMTNR1B | |
| SCHEMBL28258093 | 0.76 | CYP2A6 (0.44) | CYP2A6KIF11BACE1SIRT1HDAC3 | |
| SCHEMBL616859 | 0.76 | CYP2A6 (0.44) | CYP2A6KIF11SIRT1LOXL2 | |
| SCHEMBL7257341 | 0.75 | CYP19A1 (0.45) | CYP2A6MTNR1AMTNR1BHDAC3HDAC1 | |
| SCHEMBL1500849 | 0.75 | LOXL2 (0.64) | SIRT1LOXL2RHEBKDM4ERAB9A | |
| SCHEMBL1663549 | 0.75 | CYP2A6 (0.50) | CYP2A6MTNR1AMTNR1BSIRT1LOXL2 | |
| SCHEMBL1664310 | 0.74 | HRH3 (0.50) | BACE1MTNR1AMTNR1BSIRT1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2408454-B1 | NOVEL ANTI-INFLAMMATORY AGENTS | RESVERLOGIX CORP (CA) | 2024-07-24 | — | — | EP | disclosed |