Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.48 |
| ▸ | CCR5 | P51681 | 2/20 | 0.48 |
| ▸ | CCR8 | P51685 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 7/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.40 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL29847528 | 0.83 | CCR1 (0.54) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL20600750 | 0.83 | CCR1 (0.54) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL4301781 | 0.81 | CCR1 (0.52) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL1714632 | 0.81 | CCR1 (0.52) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL4296194 | 0.80 | CCR1 (0.50) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL28085879 | 0.80 | CCR1 (0.50) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL2436264 | 0.80 | CCR1 (0.50) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL4295312 | 0.80 | CCR1 (0.50) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL22125667 | 0.79 | CCR1 (0.48) | CCR1CCR5CCR8HTTSLC6A2 | |
| SCHEMBL20392832 | 0.79 | CCR1 (0.48) | CCR1CCR5CCR8HTTSLC6A2 |
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-2012002577-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | 富士フイルム株式会社 (JP) | 2012-01-05 | — | — | WO | disclosed |