Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CDK4 | P11802 | 6/20 | 0.38 |
| ▸ | CCND1 | P24385 | 6/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 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 | |
|---|---|---|---|---|
| SCHEMBL24656828 | 0.96 | CA12 (0.43) | HSD17B1HSD17B2CA12CA1CA2 | |
| SCHEMBL24655291 | 0.95 | CYP1A2 (0.39) | HSD17B1HSD17B2CDK4CCND1CYP1A2 | |
| SCHEMBL24657292 | 0.95 | CYP1A2 (0.39) | HSD17B1HSD17B2CDK4CCND1CYP1A2 | |
| SCHEMBL24656825 | 0.95 | CYP1A2 (0.39) | HSD17B1HSD17B2CDK4CCND1CYP1A2 | |
| SCHEMBL24656782 | 0.95 | CYP1A2 (0.39) | HSD17B1HSD17B2CDK4CCND1CYP1A2 | |
| SCHEMBL24657451 | 0.95 | CYP1A2 (0.39) | HSD17B1HSD17B2CDK4CCND1CYP1A2 | |
| SCHEMBL24655466 | 0.95 | CYP1A2 (0.39) | HSD17B1HSD17B2CDK4CCND1CYP1A2 | |
| SCHEMBL24655179 | 0.95 | CYP1A2 (0.39) | HSD17B1HSD17B2CDK4CCND1CYP1A2 | |
| SCHEMBL24655543 | 0.94 | CA12 (0.42) | HSD17B1HSD17B2CA12CA1CA2 | |
| SCHEMBL24657169 | 0.93 | CYP1A2 (0.38) | HSD17B1HSD17B2CDK4CCND1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4243100-A1 | ORGANIC LIGHT-EMITTING DEVICE | Lg Chem, Ltd. (KR) | 2023-09-13 | — | — | EP | disclosed |
| WO-2022177374-A1 | ORGANIC LIGHT-EMITTING DEVICE | 주식회사 엘지화학 | 2022-08-25 | — | — | WO | disclosed |