Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 9/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 9/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 9/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.32 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | PRKDC | P78527 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | PDE5A | O76074 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23947098 | 0.83 | AHR (0.33) | L3MBTL1 | |
| SCHEMBL23947576 | 0.83 | IGF1R (0.40) | KDM4EHPGDL3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL25470260 | 0.81 | PIK3CA (0.32) | PRKDC | |
| SCHEMBL23944259 | 0.81 | CDK5 (0.32) | EGFRIGF1RFLT4KDR | |
| SCHEMBL25466303 | 0.81 | IKBKB (0.34) | IKBKBCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL25466295 | 0.78 | IKBKB (0.34) | IKBKBCYP1A1CYP1A2CYP1B1KDM4E | |
| SCHEMBL25494985 | 0.78 | NPC1 (0.33) | CYP1A1CYP1A2CYP3A4TSHRCYP2C19 | |
| SCHEMBL24028519 | 0.78 | KMT2A (0.35) | IKBKBCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL25470369 | 0.77 | KDM4E (0.31) | CYP1A2CYP1B1KDM4EPRKDCALDH1A1 | |
| SCHEMBL25493643 | 0.77 | KDM4E (0.31) | KDM4EALDH1A1 |
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-2023085834-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-05-19 | — | — | WO | disclosed |