Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 8/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 5/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19939334 | 0.96 | CLK4 (0.48) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL19939325 | 0.95 | CYP1A2 (0.49) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL21131861 | 0.94 | CLK4 (0.46) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL22986957 | 0.92 | ABCG2 (0.47) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL22883281 | 0.91 | CYP1A2 (0.47) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL22987041 | 0.91 | ABCG2 (0.48) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL22987219 | 0.90 | CYP1A2 (0.56) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL25871981 | 0.89 | CYP1A2 (0.52) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL19942096 | 0.89 | MEN1 (0.43) | CYP1A2CYP3A4CLK4LMNACYP2D6 | |
| SCHEMBL19942323 | 0.88 | CYP1A2 (0.48) | CYP1A2CYP3A4CLK4LMNACYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20210050528-A1 | ORGANIC LIGHT EMITTING DIODE | LG CHEM, LTD. (KR) | 2021-02-18 | — | — | US | disclosed |