Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA9 | Q16790 | 3/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | RORB | Q92753 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL14410440 | 0.85 | MCL1 (0.47) | ALOX5KDM4ECYP2C19MCL1ACMSD | |
| SCHEMBL22701806 | 0.82 | LIMK1 (0.47) | ALOX5CYP1A2KDM4EF9 | |
| SCHEMBL25567737 | 0.82 | LIMK1 (0.47) | ALOX5CYP1A2KDM4EF9 | |
| SCHEMBL24787556 | 0.82 | ALOX5 (0.40) | ALOX5CYP1A2CYP2A6CYP1A1CYP1B1 | |
| SCHEMBL20041175 | 0.82 | ALOX5 (0.47) | ALOX5CYP1A2KDM4EALDH1A1RAB9A | |
| SCHEMBL430104 | 0.81 | ALOX5 (0.47) | ALOX5ALDH1A1HSD17B10MCL1ACMSD | |
| SCHEMBL25567463 | 0.81 | CA12 (0.42) | ALOX5CYP1A2CYP2A6CYP1A1CYP1B1 | |
| SCHEMBL22701898 | 0.81 | LIMK1 (0.46) | ALOX5CYP1A2KDM4ERORBF9 | |
| SCHEMBL17945727 | 0.80 | ALOX5 (0.49) | ALOX5CYP1A2CYP1A1CYP1B1MCL1 | |
| SCHEMBL19110256 | 0.80 | ALOX5 (0.49) | ALOX5CYP1A2CYP1A1CYP1B1MCL1 |
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-2020235955-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 (KR) | 2020-11-26 | — | — | WO | disclosed |