Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 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 | |
|---|---|---|---|---|
| SCHEMBL20934388 | 0.97 | KDM4E (0.38) | ALDH1A1KDM4EMAPTHPGDSMN1; SMN2 | |
| SCHEMBL20933522 | 0.96 | KDM4E (0.37) | ALDH1A1KDM4EMAPTHPGDSMN1; SMN2 | |
| SCHEMBL20933948 | 0.94 | KDM4E (0.36) | ALDH1A1KDM4EMAPTHPGDSMN1; SMN2 | |
| SCHEMBL20934405 | 0.94 | KDM4E (0.31) | ALDH1A1KDM4EMAPTHPGDSMN1; SMN2 | |
| SCHEMBL20933122 | 0.93 | PDK2 (0.33) | MAPK1TSHRL3MBTL1LMNAPDK2 | |
| SCHEMBL20933106 | 0.93 | KDM4E (0.36) | ALDH1A1KDM4EMAPTHPGDSMN1; SMN2 | |
| SCHEMBL20933598 | 0.93 | KDM4E (0.36) | ALDH1A1KDM4EMAPTHPGDSMN1; SMN2 | |
| SCHEMBL20933123 | 0.91 | PDK2 (0.32) | MAPK1TSHRL3MBTL1LMNAPDK2 | |
| SCHEMBL20933134 | 0.91 | PDK2 (0.32) | MAPK1TSHRL3MBTL1LMNAPDK2 | |
| SCHEMBL20933738 | 0.91 | KDM4E (0.35) | ALDH1A1KDM4EMAPTHPGDSMN1; SMN2 |
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-2019078461-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2019-04-25 | — | — | WO | disclosed |