Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 4/20 | 0.33 |
| ▸ | BCHE | P06276 | 3/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | JAK3 | P52333 | 1/20 | 0.31 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14909075 | 1.00 | KHK (0.34) | KHKACHEBCHEJAK2JAK3 | |
| SCHEMBL14910361 | 0.85 | KHK (0.37) | KHKACHEBCHES1PR3 | |
| SCHEMBL14910363 | 0.85 | KHK (0.37) | KHKACHEBCHES1PR3 | |
| SCHEMBL14909736 | 0.85 | ACHE (0.34) | KHKACHEBCHEJAK2JAK3 | |
| SCHEMBL14909735 | 0.85 | ACHE (0.34) | KHKACHEBCHEJAK2JAK3 | |
| SCHEMBL14911191 | 0.83 | KHK (0.36) | KHK | |
| SCHEMBL14911192 | 0.83 | KHK (0.36) | KHK | |
| SCHEMBL14909516 | 0.82 | KHK (0.34) | KHK | |
| SCHEMBL14908685 | 0.82 | KHK (0.34) | KHK | |
| SCHEMBL14911504 | 0.82 | KHK (0.34) | KHK |
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-2589592-B1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | FUJIFILM CORP (JP) | 2018-08-22 | — | — | EP | disclosed |
| EP-2589592-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | FUJIFILM Corporation (JP) | 2013-05-08 | — | — | EP | disclosed |