Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 4/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | FPR3 | P25089 | 1/20 | 0.31 |
| ▸ | FPR2 | P25090 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL845334 | 0.89 | ITGB1 (0.39) | ADRB1NAMPTCHRNA7EPHX2ITGB1 | |
| SCHEMBL873383 | 0.87 | CHRNA7 (0.36) | NAMPTCHRNA7HDAC1FPR3FPR2 | |
| SCHEMBL845190 | 0.84 | EPHX2 (0.42) | EPHX2ITGB1ITGA4CYP3A4HTR1A | |
| SCHEMBL845622 | 0.82 | ITGB1 (0.42) | NAMPTCHRNA7ITGB1ITGA4PAX8 | |
| SCHEMBL845086 | 0.81 | EPHX2 (0.40) | EPHX2ITGB1ITGA4CYP3A4HTR1A | |
| SCHEMBL845351 | 0.79 | ITGB1 (0.41) | NAMPTCHRNA7ITGB1ITGA4PAX8 | |
| SCHEMBL845441 | 0.77 | GAA (0.43) | EPHX2ITGB1ITGA4CYP3A4 | |
| SCHEMBL10119279 | 0.77 | EPHX2 (0.37) | EPHX2ITGB1ITGA4CYP3A4HTR1A | |
| SCHEMBL10119286 | 0.75 | SCN3A (0.39) | EPHX2CYP3A4HDAC1FPR3FPR2 | |
| SCHEMBL872288 | 0.75 | ITGB1 (0.37) | NAMPTCHRNA7ITGB1ITGA4PAX8 |
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 |