Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.45 |
| ▸ | ACP1 | P24666 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17828828 | 0.92 | CYP1A1 (0.40) | CYP1A1CYP1A2CYP1B1ACP1MAPT | |
| SCHEMBL17828886 | 0.92 | CYP1A1 (0.40) | CYP1A1CYP1A2CYP1B1ACP1MAPT | |
| SCHEMBL18026405 | 0.92 | CYP1A1 (0.46) | CYP1A1CYP1A2CYP1B1ACP1MAPT | |
| SCHEMBL17828871 | 0.91 | CYP1A1 (0.39) | CYP1A1CYP1A2CYP1B1ACP1MAPT | |
| SCHEMBL18026385 | 0.91 | CYP1A1 (0.41) | CYP1A1CYP1A2CYP1B1ACP1MAPT | |
| SCHEMBL17828870 | 0.88 | KDM4E (0.41) | CYP1A1CYP1A2CYP1B1ACP1ABCG2 | |
| SCHEMBL17828927 | 0.87 | L3MBTL1 (0.43) | CYP1A1CYP1A2CYP1B1ACP1MAPT | |
| SCHEMBL17829122 | 0.86 | L3MBTL1 (0.42) | CYP1A1CYP1A2CYP1B1MAPTABCG2 | |
| SCHEMBL17828928 | 0.86 | L3MBTL1 (0.42) | CYP1A1CYP1A2CYP1B1MAPTABCG2 | |
| SCHEMBL17828802 | 0.86 | KDM4E (0.39) | CYP1A1CYP1A2CYP1B1ACP1ABCG2 |
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-2021230651-A1 | ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2021-11-18 | — | — | WO | disclosed |