Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 15/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | NSD2 | O96028 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.30 |
| ▸ | ALK | Q9UM73 | 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 | |
|---|---|---|---|---|
| SCHEMBL9733508 | 0.89 | PGR (0.32) | BACE1POLBPGRCASP3ALK | |
| SCHEMBL9734001 | 0.88 | POLB (0.33) | BACE1POLBPGRNSD2CASP3 | |
| SCHEMBL9735213 | 0.85 | POLB (0.33) | BACE1POLBPGRNSD2CASP3 | |
| SCHEMBL9733596 | 0.84 | VCAM1 (0.34) | ALK | |
| SCHEMBL9734356 | 0.83 | POLB (0.34) | BACE1POLBPGRNSD2CASP3 | |
| SCHEMBL9733641 | 0.82 | OTUD7B (0.31) | — | |
| SCHEMBL9733571 | 0.81 | POLB (0.33) | BACE1POLBPGRNSD2CASP3 | |
| SCHEMBL9733222 | 0.80 | POLB (0.34) | BACE1POLBPGRNSD2CASP3 | |
| SCHEMBL8077281 | 0.79 | PDE4A (0.42) | CASP3 | |
| SCHEMBL9733168 | 0.79 | ABCC9 (0.34) | ALK |
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-5132307-A | TETRALIN COMPOUNDS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-07-21 | — | — | US | disclosed |
| EP-0368160-A1 | Tetralin derivatives | MERCK PATENT GmbH (DE) | 1990-05-16 | — | — | EP | disclosed |