Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL844996 | 0.90 | CYP2C9 (0.50) | ALDH1A1CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL845350 | 0.88 | MAPK1 (0.49) | ALDH1A1CYP2C9CYP2C19CYP1A2MAPK1 | |
| SCHEMBL845131 | 0.88 | PABPC1 (0.49) | ALDH1A1CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL845007 | 0.88 | PABPC1 (0.49) | ALDH1A1CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL845443 | 0.88 | CYP2C9 (0.47) | ALDH1A1CYP2C9CYP2C19MAPTMAPK1 | |
| SCHEMBL845257 | 0.88 | TRPV1 (0.48) | ALDH1A1CYP2C9CYP2C19MAPTKMT2A | |
| SCHEMBL845284 | 0.87 | MAPK1 (0.58) | ALDH1A1CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL845016 | 0.87 | CYP2C9 (0.47) | ALDH1A1CYP2C9CYP2C19MAPTKMT2A | |
| SCHEMBL845285 | 0.87 | GAA (0.48) | ALDH1A1CYP2C9CYP2C19MAPK1HTT | |
| SCHEMBL844980 | 0.86 | ALDH1A1 (0.45) | ALDH1A1CYP2C9CYP2C19POLBMAPT |
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 |