Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | EDNRA | P25101 | 9/20 | 0.48 |
| ▸ | F2 | P00734 | 3/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1105200 | 0.79 | CA2 (0.65) | CA2CYP1A2CYP2C19HTTHIF1A | |
| Acetonitrile SCHEMBL8500753 | 0.78 | CA2 (0.59) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL15641730 | 0.77 | CA2 (0.63) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL28337330 | 0.77 | CA2 (0.55) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL7558142 | 0.76 | CA2 (0.61) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL6046339 | 0.76 | CA2 (0.61) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL10344363 | 0.75 | CA2 (0.69) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL21283 | 0.75 | CA2 (0.69) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL563863 | 0.75 | CA2 (0.69) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL29429225 | 0.75 | CA2 (0.69) | CA2CYP1A2CYP2C19HTTHIF1A |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111983044-B | Detection method for analyzing steroid hormone based on double-derivative treatment | 中国科学院大连化学物理研究所 | 2023-04-11 | — | — | CN | claimed |
| CN-115902021-A | Method for quantifying dipeptide in white spirit based on dansylation and liquid chromatography-mass spectrometry | 贵州茅台酒股份有限公司 | 2023-04-04 | — | — | CN | claimed |
| CN-114624343-B | Method for relatively quantifying 45 inflammations and immune metabolites in serum | 中国科学院大连化学物理研究所 | 2023-01-24 | — | — | CN | claimed |
| CN-115201340-A | Method for detecting gamma-aminobutyric acid in plant-based food and dairy products | 内蒙古伊利实业集团股份有限公司 | 2022-10-18 | — | — | CN | claimed |
| CN-111983044-A | Detection method for analyzing steroid hormone based on double-derivative treatment | 中国科学院大连化学物理研究所 | 2020-11-24 | — | — | CN | claimed |
| CN-111721853-A | Method for detecting catecholamine substances in blood plasma by using liquid chromatography tandem mass spectrometry | 浙江湖州三体生物科技有限公司 | 2020-09-29 | — | — | CN | claimed |
| CN-117907470-A | Device and method for rapidly detecting metformin in health-care product | 桂林医学院 | 2024-04-19 | — | — | CN | disclosed |
| CN-111983044-B | Detection method for analyzing steroid hormone based on double-derivative treatment | 中国科学院大连化学物理研究所 | 2023-04-11 | — | — | CN | disclosed |
| CN-115902021-A | Method for quantifying dipeptide in white spirit based on dansylation and liquid chromatography-mass spectrometry | 贵州茅台酒股份有限公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-115902021-A | Method for quantifying dipeptide in white spirit based on dansylation and liquid chromatography-mass spectrometry | 贵州茅台酒股份有限公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-114624343-B | Method for relatively quantifying 45 inflammations and immune metabolites in serum | 中国科学院大连化学物理研究所 | 2023-01-24 | — | — | CN | disclosed |
| CN-115201340-A | Method for detecting gamma-aminobutyric acid in plant-based food and dairy products | 内蒙古伊利实业集团股份有限公司 | 2022-10-18 | — | — | CN | disclosed |
| CN-115047120-A | Dansyl chloride derivatization method for analyzing and detecting dipeptide substances in white spirit Daqu | 贵州茅台酒股份有限公司 | 2022-09-13 | — | — | CN | disclosed |
| CN-114624343-A | Method for relative quantification of 45 inflammations and immune metabolites in serum | 中国科学院大连化学物理研究所 | 2022-06-14 | — | — | CN | disclosed |
| CN-111983044-A | Detection method for analyzing steroid hormone based on double-derivative treatment | 中国科学院大连化学物理研究所 | 2020-11-24 | — | — | CN | disclosed |
| CN-111721853-A | Method for detecting catecholamine substances in blood plasma by using liquid chromatography tandem mass spectrometry | 浙江湖州三体生物科技有限公司 | 2020-09-29 | — | — | CN | disclosed |
| CN-109187832-A | LC-MS/MS measures the method for neo-synephrine concentration and the pre-treating method of sample in blood plasma | 华润三九医药股份有限公司 | 2019-01-11 | — | — | CN | disclosed |