Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | SLC15A2 | Q16348 | 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 | |
|---|---|---|---|---|
| SCHEMBL15755909 | 0.79 | ALDH1A1 (0.40) | ALDH1A1TDP1TRPA1HMGCRCHRM1 | |
| SCHEMBL10001246 | 0.75 | ALDH1A1 (0.37) | ALDH1A1TDP1TRPA1HMGCRCHRM1 | |
| SCHEMBL1669880 | 0.75 | ALDH1A1 (0.38) | ALDH1A1TDP1TRPA1HMGCRCHRM1 | |
| SCHEMBL1056782 | 0.73 | — | — | |
| SCHEMBL11439849 | 0.73 | ALDH1A1 (0.41) | ALDH1A1TDP1TRPA1HMGCRCHRM1 | |
| SCHEMBL12836892 | 0.73 | ALDH1A1 (0.40) | ALDH1A1TDP1TRPA1HMGCRCHRM1 | |
| SCHEMBL11397668 | 0.71 | — | — | |
| SCHEMBL28494 | 0.71 | — | — | |
| SCHEMBL10571434 | 0.71 | ALDH1A1 (0.39) | ALDH1A1TDP1TRPA1HMGCRCHRM1 | |
| SCHEMBL7041938 | 0.71 | HMGCR (0.58) | ALDH1A1TDP1TRPA1HMGCRCHRM1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110498782-A | A kind of continuous preparation method of 2,5- dimethyl -4- hydroxyl -3 (2H) furanone | XIAMEN OAMIC BIOTECH CO LTD | 2019-11-26 | — | — | CN | claimed |
| CN-109879742-A | A kind of preparation method of 3,4- dihydroxy -2,5- acetyl butyryl | 安徽金禾实业股份有限公司 | 2019-06-14 | — | — | CN | claimed |
| CN-102452915-B | Preparation method of 3,4-dihydroxy-2,5-hexanedione | SHANGHAI WANXIANG DAILY CHEMICAL CO LTD | 2014-07-09 | — | — | CN | claimed |
| CN-110498782-A | A kind of continuous preparation method of 2,5- dimethyl -4- hydroxyl -3 (2H) furanone | XIAMEN OAMIC BIOTECH CO LTD | 2019-11-26 | — | — | CN | disclosed |
| CN-110372646-A | A kind of preparation method of furanone | 安徽金轩科技有限公司 | 2019-10-25 | — | — | CN | disclosed |
| CN-109879742-A | A kind of preparation method of 3,4- dihydroxy -2,5- acetyl butyryl | 安徽金禾实业股份有限公司 | 2019-06-14 | — | — | CN | disclosed |
| CN-102452915-B | Preparation method of 3,4-dihydroxy-2,5-hexanedione | SHANGHAI WANXIANG DAILY CHEMICAL CO LTD | 2014-07-09 | — | — | CN | disclosed |
| CN-102452915-A | Preparation method of 3, 4-dihydroxy-2, 5-hexanedione | SHANGHAI WANXIANG DAILY CHEMICAL CO LTD | 2012-05-16 | — | — | CN | disclosed |