Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 6/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | PLK4 | O00444 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CSF1R | P07333 | 1/20 | 0.35 |
| ▸ | LYN | P07948 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30020373 | 0.88 | CYP1A1 (0.51) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 | |
| SCHEMBL25790537 | 0.86 | ALOX5 (0.46) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 | |
| SCHEMBL24469323 | 0.84 | CYP1A1 (0.46) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 | |
| SCHEMBL17382927 | 0.84 | ALOX5 (0.40) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 | |
| SCHEMBL17383087 | 0.84 | CYP1A1 (0.43) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 | |
| SCHEMBL25460203 | 0.83 | CYP1A1 (0.45) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 | |
| SCHEMBL24469327 | 0.83 | CYP1A1 (0.45) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 | |
| SCHEMBL17382965 | 0.83 | ALOX5 (0.40) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 | |
| SCHEMBL17382912 | 0.83 | CYP1A1 (0.40) | CYP1A1CYP1B1CYP1A2ALOX5CA12 | |
| SCHEMBL17383094 | 0.82 | CYP1A1 (0.42) | CYP1A1CYP1B1CYP1A2LIMK1ALOX5 |
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-2020231197-A1 | ORGANIC ELECTRIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2020-11-19 | — | — | WO | disclosed |