Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.32 |
| ▸ | RELA | Q04206 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22913845 | 0.85 | SMN1; SMN2 (0.36) | TP53MAPTNFKB1MAPK1NFKB2 | |
| SCHEMBL23920957 | 0.83 | KDM4E (0.37) | TP53MAPTNFKB1MAPK1NFKB2 | |
| SCHEMBL23921022 | 0.82 | ENPP1 (0.37) | TP53MAPTNFKB1MAPK1NFKB2 | |
| SCHEMBL21662067 | 0.81 | ADORA2A (0.33) | MAPTL3MBTL1RAB9ATSHRATM | |
| SCHEMBL23921290 | 0.81 | KDM4E (0.40) | TP53MAPTNFKB1MAPK1NFKB2 | |
| SCHEMBL22923984 | 0.80 | HTT (0.30) | — | |
| SCHEMBL24949973 | 0.79 | KDM4E (0.31) | TP53SMN1; SMN2CYP1A2KDM4EALDH1A1 | |
| SCHEMBL23920950 | 0.79 | ENPP1 (0.40) | TP53MAPTNFKB1MAPK1NFKB2 | |
| SCHEMBL21662066 | 0.78 | CD274 (0.31) | — | |
| SCHEMBL21304204 | 0.78 | KDM4E (0.36) | TP53SMN1; SMN2CYP1A2KDM4EALDH1A1 |
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-2021015497-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2021-01-28 | — | — | WO | disclosed |