Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 14/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 14/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4823231 | 0.78 | ALDH1A1 (0.43) | MTNR1AMTNR1BALDH1A1MAPK1KDM4E | |
| SCHEMBL13114281 | 0.78 | NR1I2 (0.35) | MTNR1AMTNR1BALDH1A1MAPK1KDM4E | |
| SCHEMBL4823223 | 0.76 | NR1I2 (0.47) | MTNR1AMTNR1BALDH1A1MAPK1KDM4E | |
| SCHEMBL772588 | 0.68 | MTNR1A (0.43) | MTNR1AMTNR1BALDH1A1KDM4EMAPT | |
| SCHEMBL394064 | 0.68 | NR1I2 (0.43) | ALDH1A1MAPK1KDM4ECYP3A4CYP2C9 | |
| SCHEMBL12429623 | 0.67 | SCN9A (0.43) | ALDH1A1MAPK1CYP3A4NPSR1LMNA | |
| SCHEMBL3097455 | 0.66 | PRKCA (0.43) | ALDH1A1MAPK1KDM4ECYP3A4CYP2C9 | |
| SCHEMBL394494 | 0.66 | PRKCA (0.46) | ALDH1A1KDM4ECYP3A4CYP2C9HPGD | |
| SCHEMBL13940285 | 0.66 | NR1I2 (0.42) | ALDH1A1MAPK1KDM4ECYP3A4MAPT | |
| SCHEMBL3565283 | 0.66 | PRKCA (0.46) | ALDH1A1KDM4ECYP3A4CYP2C9HPGD |
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-2007092000-A1 | INHIBITORS OF HCV REPLICATION | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-08-16 | — | — | WO | disclosed |