Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL20068256 | 0.97 | ALDH1A1 (0.50) | ALDH1A1SLC18A3 | |
| SCHEMBL20798535 | 0.94 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL9451625 | 0.85 | ALDH1A1 (0.44) | ALDH1A1 | |
| SCHEMBL2999797 | 0.78 | ALDH1A1 (0.89) | ALDH1A1SLC18A3 | |
| SCHEMBL22117137 | 0.78 | NOS1 (0.30) | — | |
| Tetrahydrothiophene SCHEMBL22158347 | 0.78 | NOS1 (0.30) | — | |
| SCHEMBL22284066 | 0.78 | ALDH1A1 (0.89) | ALDH1A1SLC18A3 | |
| SCHEMBL619051 | 0.78 | NOS1 (0.30) | — | |
| Biphenyl SCHEMBL2997707 | 0.78 | ALDH1A1 (0.89) | ALDH1A1SLC18A3 | |
| SCHEMBL22284064 | 0.78 | ALDH1A1 (0.89) | ALDH1A1SLC18A3 |
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-20180070645-A1 | VAPORIZATION DEVICE SYSTEMS AND METHODS | VMR PRODUCTS LLC | 2018-03-15 | — | — | US | disclosed |