Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.34 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | CDC25B | P30305 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 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 | |
|---|---|---|---|---|
| SCHEMBL17885104 | 0.88 | MEN1 (0.37) | NPC1RAB9AATMGAAMEN1 | |
| SCHEMBL22019064 | 0.86 | CYP2A6 (0.47) | CYP2A6NPC1RAB9AMAPK14ATM | |
| SCHEMBL12447535 | 0.86 | NPC1 (0.41) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL17885095 | 0.85 | AVPR1A (0.37) | DHODHNPC1RAB9AATMGAA | |
| SCHEMBL21157830 | 0.83 | AVPR1A (0.42) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL21157087 | 0.82 | FAAH (0.39) | NPC1RAB9AATMKMT2AGRM5 | |
| SCHEMBL14295988 | 0.81 | AVPR1A (0.40) | DHODHNPC1RAB9AATMMEN1 | |
| SCHEMBL17885096 | 0.80 | L3MBTL1 (0.37) | MAPK14ATMGAAMEN1KMT2A | |
| SCHEMBL17177966 | 0.79 | L3MBTL1 (0.53) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL17885112 | 0.79 | L3MBTL1 (0.36) | DHODHATMGAAMEN1KMT2A |
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-2016104954-A2 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2016-06-30 | — | — | WO | disclosed |