Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | ITGB1 | P05556 | 5/20 | 0.50 |
| ▸ | ITGA4 | P13612 | 5/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL845373 | 0.97 | ALDH1A1 (0.57) | ALDH1A1ITGB1ITGA4NPSR1TSHR | |
| SCHEMBL15116912 | 0.92 | ALDH1A1 (0.56) | ALDH1A1ITGB1ITGA4KDM4ELMNA | |
| SCHEMBL845111 | 0.92 | ALDH1A1 (0.56) | ALDH1A1ITGB1ITGA4KDM4ELMNA | |
| SCHEMBL845205 | 0.92 | ALDH1A1 (0.56) | ALDH1A1ITGB1ITGA4KDM4ELMNA | |
| SCHEMBL13272444 | 0.92 | ALDH1A1 (0.56) | ALDH1A1ITGB1ITGA4KDM4ELMNA | |
| SCHEMBL845226 | 0.92 | ALDH1A1 (0.56) | ALDH1A1ITGB1ITGA4KDM4ELMNA | |
| SCHEMBL1030175 | 0.92 | ALDH1A1 (0.56) | ALDH1A1ITGB1ITGA4KDM4ELMNA | |
| SCHEMBL845154 | 0.89 | ALDH1A1 (0.54) | ALDH1A1ITGB1ITGA4NPSR1KDM4E | |
| SCHEMBL845408 | 0.89 | ALDH1A1 (0.54) | ALDH1A1ITGB1ITGA4NPSR1KDM4E | |
| SCHEMBL845406 | 0.89 | ALDH1A1 (0.54) | ALDH1A1ITGB1ITGA4NPSR1TSHR |
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-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |