Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | EGLN1 | Q9GZT9 | 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 | |
|---|---|---|---|---|
| SCHEMBL20629195 | 1.00 | ALDH1A1 (0.31) | ALDH1A1LMNAABCC4MAPTEGLN1 | |
| SCHEMBL882336 | 1.00 | ALDH1A1 (0.31) | ALDH1A1LMNAABCC4MAPTEGLN1 | |
| SCHEMBL882266 | 0.92 | ABCC4 (0.35) | ALDH1A1LMNAABCC4MAPT | |
| SCHEMBL882056 | 0.79 | ALDH1A1 (0.31) | ALDH1A1LMNAABCC4MAPT | |
| SCHEMBL23394579 | 0.77 | CNR2 (0.32) | — | |
| SCHEMBL15591446 | 0.77 | CNR2 (0.32) | — | |
| SCHEMBL14979882 | 0.77 | CNR2 (0.32) | — | |
| SCHEMBL881968 | 0.77 | CNR2 (0.32) | — | |
| SCHEMBL15424600 | 0.77 | CNR2 (0.32) | — | |
| SCHEMBL14979934 | 0.75 | ALDH1A1 (0.33) | ALDH1A1 |
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-2012040040-A1 | HCV NS3 PROTEASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-03-29 | — | — | WO | disclosed |