Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 15/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13626503 | 0.84 | CFTR (0.56) | CFTRLMNAPKM | |
| SCHEMBL13626499 | 0.79 | CFTR (0.48) | CFTR | |
| SCHEMBL13626527 | 0.75 | CFTR (0.46) | CFTRLMNAPKM | |
| SCHEMBL13626534 | 0.74 | CFTR (0.49) | CFTR | |
| SCHEMBL4558064 | 0.72 | TAS1R3 (0.60) | CFTRLMNAPKM | |
| SCHEMBL13626543 | 0.71 | CFTR (0.41) | CFTRLMNAPKM | |
| SCHEMBL13626492 | 0.71 | CFTR (0.55) | CFTRLMNAPKM | |
| SCHEMBL13626517 | 0.70 | CFTR (0.50) | CFTRLMNAPKM | |
| SCHEMBL7738204 | 0.70 | HDAC8 (0.60) | — | |
| SCHEMBL3922221 | 0.69 | CFTR (0.76) | CFTR |
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 |
|---|---|---|---|---|---|---|---|
| US-7612089-B2 | Tetrahydroisoquinolines as factor Xa inhibitors | PORTOLA PHARMACEUTICALS, INC. (US) | 2009-11-03 | — | — | US | disclosed |
| US-7612089-B2 | Tetrahydroisoquinolines as factor Xa inhibitors | PORTOLA PHARMACEUTICALS, INC. (US) | 2009-11-03 | — | — | US | disclosed |