Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.35 |
| ▸ | SCARB1 | Q8WTV0 | 1/20 | 0.35 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16086028 | 0.84 | CYP3A4 (0.46) | CYP3A4CYP2D6NR1I2L3MBTL1AOC3 | |
| SCHEMBL8666649 | 0.84 | CYP3A4 (0.46) | CYP3A4CYP2D6NR1I2L3MBTL1AOC3 | |
| SCHEMBL9201638 | 0.82 | NR1I2 (0.46) | CYP3A4CYP2D6NR1I2L3MBTL1AOC3 | |
| SCHEMBL9523124 | 0.80 | CYP3A4 (0.44) | CYP3A4CYP2D6NR1I2L3MBTL1AOC3 | |
| SCHEMBL9520899 | 0.80 | CYP3A4 (0.44) | CYP3A4CYP2D6NR1I2L3MBTL1AOC3 | |
| SCHEMBL9200266 | 0.80 | NR1I2 (0.73) | CYP3A4CYP2D6NR1I2L3MBTL1AOC3 | |
| SCHEMBL8553518 | 0.80 | NR1I2 (0.49) | CYP3A4CYP2D6NR1I2L3MBTL1S1PR1 | |
| SCHEMBL16085870 | 0.80 | CYP3A4 (0.43) | CYP3A4CYP2D6NR1I2L3MBTL1AOC3 | |
| SCHEMBL9090154 | 0.79 | NR1I2 (0.46) | CYP3A4CYP2D6NR1I2L3MBTL1CA12 | |
| SCHEMBL8824422 | 0.78 | NR1I2 (0.53) | CYP3A4CYP2D6NR1I2L3MBTL1AOC3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5763461-A | ANTIPICORNAVIRAL AGENTS | SANOFI (FR) | 1998-06-09 | — | — | US | disclosed |
| US-5618821-A | VIRICIDES, PICORNAVIRUS | SANOFI, S.A. (FR) | 1997-04-08 | — | — | US | disclosed |
| WO-1995031438-A1 | THERAPEUTIC PHENOXYALKYLHETEROCYCLES | SANOFI WINTHROP, INC. (US) | 1995-11-23 | — | — | WO | disclosed |