Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28008749 | 1.00 | EPHX1 (0.37) | EPHX1KDM4EALDH1A1MAPTLMNA | |
| SCHEMBL28008748 | 1.00 | EPHX1 (0.37) | EPHX1KDM4EALDH1A1MAPTLMNA | |
| SCHEMBL8834401 | 0.84 | EPHX1 (0.35) | EPHX1KDM4EALDH1A1MAPTLMNA | |
| SCHEMBL8970243 | 0.84 | CYP2C19 (0.39) | KDM4EALDH1A1MAPTLMNACYP2C19 | |
| SCHEMBL8072246 | 0.84 | CYP2C19 (0.39) | KDM4EALDH1A1MAPTLMNACYP2C19 | |
| Butylamine SCHEMBL28004922 | 0.82 | NAAA (0.35) | EPHX1KDM4EALDH1A1MAPT | |
| SCHEMBL17889152 | 0.82 | EPHX1 (0.54) | EPHX1KDM4EALDH1A1MAPTLMNA | |
| SCHEMBL8969998 | 0.82 | KDM4E (0.35) | EPHX1KDM4EALDH1A1MAPTLMNA | |
| Hydrochloric Acid SCHEMBL8970750 | 0.82 | PEPD (0.39) | KDM4EALDH1A1MAPTLMNACYP2C19 | |
| SCHEMBL8166713 | 0.82 | EPHX1 (0.54) | EPHX1KDM4EALDH1A1MAPTLMNA |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104649877-B | A kind of preparation method of 2 methoxycyclohexyl ketone | 岳阳昌德化工实业有限公司 | 2017-06-16 | — | — | CN | claimed |
| CN-104649877-A | Preparation method of 2-methoxyl cyclohexanone | Yueyang changde chemical industry co ltd | 2015-05-27 | — | — | CN | claimed |
| CN-107001382-B | Spiral shell-thiazolone | 豪夫迈·罗氏有限公司 | 2019-10-25 | — | — | CN | disclosed |
| CN-107001382-A | Spiral shell thiazolone | 豪夫迈·罗氏有限公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-104649877-B | A kind of preparation method of 2 methoxycyclohexyl ketone | 岳阳昌德化工实业有限公司 | 2017-06-16 | — | — | CN | disclosed |
| CN-106238075-A | Molybdenum sulfide catalyst and preparation thereof and the application in fragrance phenol and ether compound hydrogenation degraded | 天津大学 | 2016-12-21 | — | — | CN | disclosed |
| CN-103788097-B | Fused ring compound and its purposes | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2016-03-30 | — | — | CN | disclosed |
| CN-101072786-B | Be suitable for the chipal compounds as asymmetric transfer hydrogenation catalyzer | DPX HOLDINGS B.V. (NL) | 2015-11-25 | — | — | CN | disclosed |
| CN-104649877-A | Preparation method of 2-methoxyl cyclohexanone | Yueyang changde chemical industry co ltd | 2015-05-27 | — | — | CN | disclosed |