Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 7/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | HPGD | P15428 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24029286 | 0.87 | CYP1A1 (0.49) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E | |
| SCHEMBL24028982 | 0.82 | AHR (0.42) | KMT2ACYP1A1CYP1A2KDM4EHPGD | |
| SCHEMBL24028978 | 0.81 | TDP1 (0.36) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E | |
| SCHEMBL22315500 | 0.77 | CYP1A2 (0.43) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E | |
| SCHEMBL24210567 | 0.75 | CYP1B1 (0.48) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E | |
| SCHEMBL30154375 | 0.74 | HPRT1 (0.57) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E | |
| SCHEMBL5470220 | 0.74 | HPRT1 (0.57) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E | |
| SCHEMBL24662741 | 0.74 | KMT2A (0.45) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E | |
| SCHEMBL24662731 | 0.73 | L3MBTL1 (0.44) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E | |
| SCHEMBL29849771 | 0.73 | ALDH1A1 (0.45) | KMT2ACYP1A1CYP1B1CYP1A2KDM4E |
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-2021230654-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-11-18 | — | — | WO | disclosed |