Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 6/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27610645 | 0.85 | ACP3 (0.34) | KDM4ETDP1MAPTLMNAGAA | |
| SCHEMBL10370767 | 0.85 | KDM4E (0.41) | KDM4ETDP1MAPTLMNAGAA | |
| SCHEMBL1650809 | 0.84 | KDM4E (0.50) | KDM4ETDP1LMNAGAAHPGD | |
| SCHEMBL31115079 | 0.83 | MAPT (0.49) | KDM4ETDP1MAPTLMNAPOLB | |
| SCHEMBL11116972 | 0.82 | KDM4E (0.39) | KDM4ETDP1MAPTLMNAGAA | |
| SCHEMBL3147406 | 0.82 | KDM4E (0.39) | KDM4ETDP1LMNAGAAPOLB | |
| SCHEMBL1260300 | 0.82 | KDM4E (0.39) | KDM4ETDP1MAPTLMNAGAA | |
| SCHEMBL7022984 | 0.81 | SMN1; SMN2 (0.46) | KDM4ETDP1MAPTLMNAPOLB | |
| SCHEMBL28242978 | 0.79 | VKORC1 (0.42) | KDM4EMAPTLMNAHPGDALDH1A1 | |
| SCHEMBL7279171 | 0.77 | KMT2A (0.45) | KDM4EMAPTGAAHPGDALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106083781-B | A kind of benzo lactone preparation method and applications with cigarette flavouring effect | 云南中烟工业有限责任公司 | 2018-08-17 | — | — | CN | disclosed |
| CN-106008422-B | A kind of benzo lactone compound, its preparation method and the application in anticancer drug is prepared | 云南中烟工业有限责任公司 | 2018-05-25 | — | — | CN | disclosed |
| CN-106083781-A | A kind of benzo lactone preparation method and applications with Medicated cigarette flavouring effect | 云南中烟工业有限责任公司 | 2016-11-09 | — | — | CN | disclosed |