Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | C1R | P00736 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3246437 | 0.83 | KDM4E (0.49) | KDM4EALDH1A1NPC1RAB9AATM | |
| SCHEMBL10264092 | 0.79 | PDK2 (0.50) | KDM4EALDH1A1NPC1RAB9ANOTUM | |
| SCHEMBL5540045 | 0.79 | KDM4E (0.59) | KDM4EALDH1A1NPC1RAB9ANOTUM | |
| SCHEMBL9954823 | 0.79 | FAAH (0.43) | KDM4EALDH1A1NPC1RAB9AATM | |
| SCHEMBL5540037 | 0.79 | KDM4E (0.55) | KDM4EALDH1A1NPC1RAB9ANOTUM | |
| SCHEMBL27690445 | 0.78 | KDM4E (0.45) | KDM4EALDH1A1NPC1RAB9AATM | |
| SCHEMBL10697035 | 0.78 | RAB9A (0.64) | KDM4EALDH1A1NPC1RAB9AATM | |
| SCHEMBL8553446 | 0.77 | ALOX15 (0.46) | KDM4EALDH1A1NPC1RAB9AATM | |
| SCHEMBL12171394 | 0.77 | RAB9A (0.56) | KDM4EALDH1A1NPC1RAB9AALOX15 | |
| SCHEMBL11619932 | 0.75 | FAAH (0.43) | KDM4EALDH1A1NPC1RAB9ANOTUM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109705012-B | Preparation method of 2, 5-diaryl five-membered heterocyclic aromatic hydrocarbon | 西北师范大学 | 2022-04-05 | — | — | CN | disclosed |
| CN-109705012-A | A kind of preparation method of 2,5- diaryl five-ring heterocycles aromatic hydrocarbons | 西北师范大学 | 2019-05-03 | — | — | CN | disclosed |