Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL845313 | 0.91 | ALDH1A1 (0.41) | ALDH1A1POLBCYP2C9CYP2C19KMT2A | |
| SCHEMBL845620 | 0.85 | MAPT (0.52) | ALDH1A1POLBCYP2C19KMT2AMEN1 | |
| SCHEMBL845048 | 0.83 | DGAT1 (0.50) | ALDH1A1CYP2C9CYP2C19DGAT1MAPK1 | |
| SCHEMBL845008 | 0.81 | ALDH1A1 (0.54) | ALDH1A1POLBCYP2C9CYP2C19KMT2A | |
| SCHEMBL845338 | 0.80 | RHOC (0.48) | ALDH1A1POLBCYP2C9CYP2C19KMT2A | |
| SCHEMBL845250 | 0.79 | HCRTR1 (0.46) | ALDH1A1CYP2C9CYP2C19DGAT1MAPK1 | |
| SCHEMBL845300 | 0.79 | CYP2C9 (0.54) | ALDH1A1CYP2C9CYP2C19MAPK1HTT | |
| SCHEMBL845333 | 0.79 | PABPC1 (0.48) | ALDH1A1CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL845405 | 0.79 | TRPV1 (0.46) | POLBCYP2C9CYP2C19KMT2ADGAT1 | |
| SCHEMBL845049 | 0.79 | LMNA (0.48) | ALDH1A1POLBKMT2AHTTNPSR1 |
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 2 patents. 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 |
| US-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |