Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | CCR8 | P51685 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22481921 | 0.80 | — | — | |
| SCHEMBL19756394 | 0.73 | CCR1 (0.33) | CCR1CCR5CCR8NOS3NOS1 | |
| SCHEMBL2874247 | 0.68 | CHRNB2 (0.38) | — | |
| SCHEMBL469266 | 0.68 | CYP19A1 (0.31) | — | |
| SCHEMBL19074944 | 0.68 | HRH3 (0.34) | — | |
| SCHEMBL13174573 | 0.67 | CCR1 (0.34) | CCR1CCR5CCR8NOS3NOS1 | |
| SCHEMBL13662468 | 0.67 | S100A4 (0.32) | CCR1CCR5 | |
| SCHEMBL20748620 | 0.66 | PARP1 (0.36) | — | |
| SCHEMBL23505995 | 0.66 | — | — | |
| SCHEMBL12569459 | 0.65 | CCR1 (0.33) | CCR1CCR5CCR8NOS3NOS1 |
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-2332905-B1 | BCRP/ABCG2 Inhibitor | YAKULT HONSHA KK (JP) | 2017-03-01 | — | — | EP | disclosed |