Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL560340 | 1.00 | CYP2A6 (0.52) | CYP2A6CYP3A4ALDH1A1CYP1A2PTGS2 | |
| SCHEMBL28301564 | 0.87 | PTGS2 (0.43) | CYP2A6CYP3A4ALDH1A1CYP1A2PTGS2 | |
| SCHEMBL2650696 | 0.82 | CYP11B1 (0.47) | CYP2A6CYP3A4ALDH1A1CYP1A2PTGS2 | |
| SCHEMBL20541087 | 0.81 | CYP2A6 (0.70) | CYP2A6CYP3A4ALDH1A1CYP1A2PTGS2 | |
| SCHEMBL30026143 | 0.81 | CYP2A6 (0.70) | CYP2A6CYP3A4ALDH1A1CYP1A2PTGS2 | |
| SCHEMBL28019540 | 0.80 | CYP11B1 (0.51) | CYP2A6CYP3A4ALDH1A1CYP1A2PTGS2 | |
| SCHEMBL23152013 | 0.80 | NOTUM (0.44) | ALDH1A1SMN1; SMN2LMNATP53MAPT | |
| SCHEMBL28019022 | 0.80 | CYP11B1 (0.50) | CYP2A6CYP3A4ALDH1A1CYP1A2PTGS2 | |
| SCHEMBL21110859 | 0.79 | CYP2A6 (0.67) | CYP2A6CYP3A4ALDH1A1CYP1A2PTGS2 | |
| SCHEMBL21933 | 0.79 | ALDH1A1 (0.48) | CYP2A6ALDH1A1PTGS2HPGDSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111183134-B | Heterocyclic compound and organic light-emitting device comprising the same | LT素材株式会社 | 2025-05-09 | — | — | CN | disclosed |
| CN-116425730-A | Organic electroluminescent compounds and use thereof | 宁波卢米蓝新材料有限公司 | 2023-07-14 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |