Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.31 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.31 |
| ▸ | QPCT | Q16769 | 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 | |
|---|---|---|---|---|
| SCHEMBL4724221 | 0.91 | NTRK1 (0.33) | NTRK1PTK2IMPDH2IMPDH1QPCT | |
| SCHEMBL4722031 | 0.85 | PTK2 (0.33) | PTK2IMPDH2IMPDH1 | |
| SCHEMBL4723056 | 0.81 | LMNA (0.32) | PTK2IMPDH2IMPDH1 | |
| SCHEMBL4724546 | 0.80 | SYK (0.37) | — | |
| SCHEMBL4724553 | 0.80 | SYK (0.37) | — | |
| SCHEMBL4720084 | 0.80 | NAMPT (0.33) | NTRK1PTK2IMPDH2IMPDH1QPCT | |
| SCHEMBL4723349 | 0.80 | PTK2 (0.30) | PTK2 | |
| SCHEMBL4718834 | 0.79 | CYP3A4 (0.34) | — | |
| SCHEMBL4721397 | 0.79 | S1PR1 (0.31) | — | |
| SCHEMBL4721515 | 0.79 | P2RX7 (0.33) | — |
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-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |