Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.31 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.31 |
| ▸ | ACVR1 | Q04771 | 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 | |
|---|---|---|---|---|
| SCHEMBL22766998 | 0.94 | CYP1A2 (0.33) | ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10 | |
| SCHEMBL22766992 | 0.92 | PDPK1 (0.33) | ALDH1A1MAPTKDM4EHPGDTSHR | |
| SCHEMBL22767025 | 0.92 | ALDH1A1 (0.33) | ALDH1A1MAPTKDM4ETP53HPGD | |
| SCHEMBL22766997 | 0.92 | PDPK1 (0.33) | ALDH1A1MAPTKDM4EHPGDTSHR | |
| SCHEMBL22767165 | 0.91 | PDPK1 (0.32) | — | |
| SCHEMBL22767027 | 0.91 | SIRT2 (0.31) | — | |
| SCHEMBL22767154 | 0.91 | ALDH1A1 (0.33) | ALDH1A1MAPTKDM4ETP53HPGD | |
| SCHEMBL24223733 | 0.91 | ALDH1A1 (0.34) | ALDH1A1MAPTKDM4ETP53HPGD | |
| SCHEMBL22767147 | 0.91 | PRKDC (0.32) | — | |
| SCHEMBL22767033 | 0.90 | ALDH1A1 (0.31) | ALDH1A1MAPTKDM4ETP53HPGD |
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-2020246837-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2020-12-10 | — | — | WO | disclosed |