Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4496740 | 0.85 | GRM5 (0.39) | — | |
| SCHEMBL4492957 | 0.75 | GRIA2 (0.42) | — | |
| SCHEMBL4491009 | 0.75 | ALDH1A1 (0.43) | DHODH | |
| SCHEMBL4504195 | 0.73 | CCR1 (0.38) | CNR1 | |
| SCHEMBL4495795 | 0.72 | ERN1 (0.46) | CNR1 | |
| SCHEMBL4498679 | 0.72 | CCNC (0.36) | — | |
| SCHEMBL4495477 | 0.71 | ALDH1A1 (0.42) | — | |
| SCHEMBL4488653 | 0.70 | ERCC1 (0.38) | — | |
| SCHEMBL4491753 | 0.70 | POLB (0.35) | DHODH | |
| SCHEMBL4490745 | 0.69 | GRIA2 (0.40) | DHODH |
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 |
|---|---|---|---|---|---|---|---|
| US-7504429-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2009-03-17 | — | — | US | claimed |