Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10119342 | 0.95 | ALDH1A1 (0.45) | ALDH1A1NPSR1TSHRGAAHCRTR1 | |
| SCHEMBL10119347 | 0.92 | ALDH1A1 (0.43) | ALDH1A1NPSR1TSHRGAAHCRTR1 | |
| SCHEMBL845114 | 0.90 | EP300 (0.46) | ALDH1A1TRPV1POLB | |
| SCHEMBL845841 | 0.89 | TRPV1 (0.45) | ALDH1A1HCRTR1TRPV1ROCK2HCRTR2 | |
| SCHEMBL13272509 | 0.89 | TRPV1 (0.45) | ALDH1A1HCRTR1TRPV1ROCK2HCRTR2 | |
| SCHEMBL845374 | 0.88 | PABPC1 (0.51) | ALDH1A1NPSR1TSHRGAAHCRTR1 | |
| SCHEMBL10119343 | 0.86 | ALDH1A1 (0.44) | ALDH1A1NPSR1KMT2AMEN1ROCK2 | |
| SCHEMBL10119346 | 0.86 | RHOC (0.45) | ALDH1A1TSHRHCRTR1KMT2AMEN1 | |
| SCHEMBL845704 | 0.85 | TRPV1 (0.48) | ALDH1A1HCRTR1TRPV1ROCK2HCRTR2 | |
| SCHEMBL845699 | 0.85 | RHOC (0.48) | HCRTR1 |
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 |