Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 15/20 | 0.33 |
| ▸ | ABCC1 | P33527 | 7/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 6/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.33 |
| ▸ | GSK3B | P49841 | 2/20 | 0.33 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL20180402 | 0.84 | SIRT2 (0.43) | ABCG2ABCC1ABCB1MAPTSIRT2 | |
| SCHEMBL22745064 | 0.79 | PDK2 (0.44) | ABCG2ABCC1ABCB1MAPTSMN1; SMN2 | |
| SCHEMBL22214562 | 0.78 | SIRT2 (0.37) | ABCG2MAPTSIRT2SIRT1CYP1A2 | |
| SCHEMBL25125291 | 0.77 | SIRT2 (0.40) | SIRT2SIRT1 | |
| SCHEMBL30419561 | 0.77 | PDK2 (0.42) | MAPTMEN1KMT2AKDM4ELMNA | |
| SCHEMBL17887113 | 0.77 | PDK2 (0.42) | MAPTMEN1KMT2AKDM4ELMNA | |
| SCHEMBL17887032 | 0.77 | PDK2 (0.42) | MAPTMEN1KMT2AKDM4ELMNA | |
| SCHEMBL30620082 | 0.77 | PDK2 (0.42) | MAPTMEN1KMT2AKDM4ELMNA | |
| SCHEMBL17280874 | 0.77 | PDK2 (0.42) | MAPTMEN1KMT2AKDM4ELMNA | |
| SCHEMBL17887109 | 0.77 | PDK2 (0.42) | MAPTMEN1KMT2AKDM4ELMNA |
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 |