Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.32 |
| ▸ | TNF | P01375 | 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 | |
|---|---|---|---|---|
| SCHEMBL18535076 | 0.94 | SCN9A (0.36) | IRAK4 | |
| SCHEMBL18534974 | 0.83 | NR3C1 (0.30) | — | |
| SCHEMBL18535004 | 0.80 | MAPT (0.31) | — | |
| SCHEMBL18535027 | 0.79 | ALDH1A1 (0.31) | — | |
| SCHEMBL18535276 | 0.78 | CFTR (0.34) | — | |
| SCHEMBL18535101 | 0.78 | KDM4E (0.40) | — | |
| SCHEMBL18535117 | 0.77 | SYK (0.49) | — | |
| SCHEMBL14737367 | 0.76 | SYK (0.48) | — | |
| SCHEMBL14751406 | 0.73 | TLR2 (0.36) | — | |
| SCHEMBL14738395 | 0.73 | ABCB11 (0.34) | — |
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-2763990-B1 | PYRROLOPYRAZINE KINASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2017-02-22 | — | — | EP | disclosed |