Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL1959613 | 0.79 | ALDH1A1 (0.33) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL13720624 | 0.78 | KDM4E (0.48) | ADRB1ALDH1A1 | |
| SCHEMBL377165 | 0.74 | KDM4E (0.44) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL16834486 | 0.73 | PGK1 (0.38) | ALDH1A1 | |
| SCHEMBL28566083 | 0.72 | KMT2A (0.40) | ALDH1A1 | |
| SCHEMBL16834262 | 0.70 | P2RX7 (0.46) | — | |
| SCHEMBL6223869 | 0.70 | KDM4E (0.44) | ALDH1A1 | |
| SCHEMBL755699 | 0.69 | TDP1 (0.47) | ALDH1A1 | |
| SCHEMBL18952265 | 0.68 | ADORA2A (0.39) | ALDH1A1 | |
| SCHEMBL16712252 | 0.68 | GRN (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011066898-A1 | ELECTRONIC DEVICE CONTAINING METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2011-06-09 | — | — | WO | disclosed |