Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24778323 | 0.89 | CYP2A6 (0.46) | CYP1A2CYP2A6CYP1A1CYP1B1CYP2C19 | |
| SCHEMBL25569776 | 0.88 | LIMK1 (0.46) | CYP1A2CYP2A6LIMK1ALOX5MCL1 | |
| SCHEMBL24969647 | 0.88 | LIMK1 (0.48) | CYP1A2CYP2A6LIMK1ALOX5MCL1 | |
| SCHEMBL23765008 | 0.82 | PLK4 (0.35) | CYP1A2CYP2A6HDAC8HDAC6CYP1A1 | |
| SCHEMBL22701889 | 0.81 | ALOX5 (0.46) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL22129988 | 0.80 | GPR3 (0.43) | CYP1A2CYP2A6KDM4EALDH1A1RAB9A | |
| SCHEMBL24777850 | 0.78 | CYP2A6 (0.47) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL23427851 | 0.78 | CA12 (0.41) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL23981335 | 0.78 | CYP1A2 (0.50) | CYP1A2CYP2A6HDAC8HDAC6CYP1A1 | |
| SCHEMBL21096860 | 0.78 | ALOX5 (0.38) | CA12CA1CA2CA9CYP1A2 |
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-2023096209-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2023-06-01 | — | — | WO | disclosed |