Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7456742 | 0.91 | CYP1A2 (0.33) | CYP1A2CYP2A6NPC1MAPTRAB9A | |
| SCHEMBL8054073 | 0.88 | CYP1A2 (0.37) | CYP1A2CYP2A6L3MBTL1NPC1MAPT | |
| SCHEMBL7914780 | 0.85 | CYP2A6 (0.50) | CYP1A2CYP2A6ALDH1A1NR3C1PGR | |
| SCHEMBL8588453 | 0.83 | ALDH1A1 (0.41) | CYP1A2CYP2A6ALDH1A1CYP3A4HPGD | |
| SCHEMBL7459767 | 0.79 | KMT2A (0.33) | ALDH1A1CYP3A4HPGDHSD17B10L3MBTL1 | |
| SCHEMBL8590039 | 0.78 | LMNA (0.35) | ALDH1A1L3MBTL1RAB9ASMN1; SMN2 | |
| SCHEMBL8436945 | 0.77 | KMT2A (0.40) | RAB9ATSHR | |
| SCHEMBL8588371 | 0.76 | FFAR4 (0.37) | CYP1A2CYP2A6NPC1MAPTRAB9A | |
| SCHEMBL7467880 | 0.75 | CYP1A2 (0.42) | CYP1A2CYP2A6ALDH1A1HPGDHSD17B10 | |
| SCHEMBL13994403 | 0.75 | CYP1A2 (0.46) | CYP1A2CYP2A6ALDH1A1NR3C1PGR |
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-5807905-A | POLYMERIZATION OF UNSATURATED COMPOUNDS | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1998-09-15 | — | — | US | disclosed |