Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4451303 | 0.83 | ALDH1A1 (0.49) | TSHRALDH1A1LMNAHSD17B10KDM4E | |
| SCHEMBL11152734 | 0.82 | TSHR (0.59) | TSHRALDH1A1HSD17B10HPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL323673 | 0.82 | ALDH1A1 (0.47) | TSHRALDH1A1LMNAHSD17B10KDM4E | |
| SCHEMBL9545765 | 0.78 | TSHR (0.47) | TSHRALDH1A1LMNAHSD17B10MRGPRX4 | |
| SCHEMBL30426368 | 0.78 | HSD17B10 (0.47) | TSHRALDH1A1LMNAHSD17B10KDM4E | |
| SCHEMBL31019180 | 0.78 | PARP1 (0.42) | TSHRALDH1A1HSD17B10KDM4EHMGB1 | |
| SCHEMBL8706617 | 0.78 | PARP1 (0.42) | TSHRALDH1A1HSD17B10KDM4EHMGB1 | |
| SCHEMBL7893551 | 0.78 | HSD17B10 (0.47) | TSHRALDH1A1LMNAHSD17B10KDM4E | |
| SCHEMBL18049144 | 0.78 | HMGB1 (0.51) | TSHRALDH1A1LMNAHSD17B10KDM4E | |
| SCHEMBL28547247 | 0.77 | ALDH1A1 (0.43) | TSHRALDH1A1LMNAHSD17B10KDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104151183-B | A kind of preparation method of 4-acetyl aminomethyl methyl cyclohexanecarboxylaand | JIANG University OF TECHNOLOGY (CN) | 2016-04-13 | — | — | CN | claimed |
| CN-104151183-A | Preparation method of methyl 4-acetylaminomethyl hexahydrobenzoate | UNIV ZHEJIANG TECHNOLOGY | 2014-11-19 | — | — | CN | claimed |
| CN-104151183-B | A kind of preparation method of 4-acetyl aminomethyl methyl cyclohexanecarboxylaand | JIANG University OF TECHNOLOGY (CN) | 2016-04-13 | — | — | CN | disclosed |
| CN-104151183-B | A kind of preparation method of 4-acetyl aminomethyl methyl cyclohexanecarboxylaand | JIANG University OF TECHNOLOGY (CN) | 2016-04-13 | — | — | CN | disclosed |
| CN-104151183-A | Preparation method of methyl 4-acetylaminomethyl hexahydrobenzoate | UNIV ZHEJIANG TECHNOLOGY | 2014-11-19 | — | — | CN | disclosed |