Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 7/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.38 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.38 |
| ▸ | GAK | O14976 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20615297 | 0.87 | MAPT (0.40) | EGFRPTGS1PTGS2SIRT2NPC1 | |
| SCHEMBL20615335 | 0.81 | MEN1 (0.48) | SIRT2NPC1ALDH1A1RAB9AMPO | |
| SCHEMBL20180122 | 0.78 | EGFR (0.39) | EGFRPTGS1PTGS2SIRT2NPC1 | |
| SCHEMBL20180533 | 0.73 | ALDH1A1 (0.39) | EGFRPTGS1PTGS2SIRT2ABCG2 | |
| SCHEMBL384593 | 0.73 | FABP4 (0.65) | PTGS1PTGS2SIRT2NPC1ALDH1A1 | |
| SCHEMBL14137199 | 0.73 | EGFR (0.57) | EGFRPTGS1PTGS2ABCG2ALDH1A1 | |
| SCHEMBL20180153 | 0.73 | ALK (0.41) | EGFRPTGS1PTGS2ABCG2NPC1 | |
| SCHEMBL932511 | 0.72 | C1S (0.53) | NPC1ALDH1A1RAB9AMEN1LMNA | |
| SCHEMBL8470618 | 0.71 | EGFR (0.51) | EGFRPTGS1PTGS2ABCG2NPC1 | |
| SCHEMBL20180548 | 0.71 | MEN1 (0.43) | SIRT2ABCG2ALDH1A1MPOMEN1 |
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-2018093107-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME | 주식회사 두산 | 2018-05-24 | — | — | WO | disclosed |