Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.67 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.44 |
| ▸ | EP300 | Q09472 | 1/20 | 0.44 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30241908 | 0.83 | CYP2A6 (0.58) | CYP2A6CYP3A4CYP2E1HTTGAA | |
| SCHEMBL403413 | 0.80 | CYP3A4 (1.00) | CYP2A6CYP3A4CYP2E1MAPTMAPK1 | |
| SCHEMBL11122638 | 0.79 | CYP2A6 (0.64) | CYP2A6CYP3A4CYP2E1HTTCHRNB2 | |
| SCHEMBL31440787 | 0.79 | CYP2A6 (0.64) | CYP2A6CYP3A4CYP2E1HTTCHRNB2 | |
| SCHEMBL11182094 | 0.76 | CYP2A6 (0.62) | CYP2A6CYP3A4CYP2E1HTTGAA | |
| SCHEMBL28165620 | 0.76 | CYP2A6 (0.55) | CYP2A6CYP3A4CYP2E1HTTCHRNB2 | |
| SCHEMBL27559785 | 0.76 | CYP2A6 (0.55) | CYP2A6CYP3A4CYP2E1HTTCHRNB2 | |
| SCHEMBL9110239 | 0.74 | HTT (0.55) | CYP2A6CYP3A4CYP2E1HTTGAA | |
| SCHEMBL30080798 | 0.74 | HTT (0.55) | CYP2A6CYP3A4CYP2E1HTTGAA | |
| Hydrochloric Acid SCHEMBL30385194 | 0.73 | HTT (0.53) | CYP2A6CYP3A4CYP2E1HTTGAA |
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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110256606-B | A kind of two ureas chitosan derivatives of nitrogen-containing heterocycle and its preparation method and application | 中国科学院烟台海岸带研究所 | 2019-11-19 | — | — | CN | claimed |
| CN-110256606-A | A kind of two ureas chitosan derivatives of nitrogen-containing heterocycle and its preparation method and application | 中国科学院烟台海岸带研究所 | 2019-09-20 | — | — | CN | claimed |
| CN-104619328-B | The condensed quinoline alkane glucocorticoid receptor modulator of heteroaryl -one | 科赛普特治疗学股份有限公司 | 2018-10-02 | — | — | CN | claimed |
| CN-115093355-B | Preparation method of pyrrole ester compound | 河南农业大学 | 2024-06-04 | — | — | CN | disclosed |
| CN-110452243-B | Pyrrolopyrimidine derivative epidermal growth factor inhibitor and preparation method and application thereof | 药雅科技(上海)有限公司 | 2022-11-11 | — | — | CN | disclosed |
| CN-110256606-B | A kind of two ureas chitosan derivatives of nitrogen-containing heterocycle and its preparation method and application | 中国科学院烟台海岸带研究所 | 2019-11-19 | — | — | CN | disclosed |
| CN-107001383-B | Oxygen azatropylidene compound and contain the compound as the insecticide for agricultural or horticultural use of effective component and its application method | 日本农药株式会社 | 2019-07-26 | — | — | CN | disclosed |
| CN-105828610-B | Pesticidal compositions and methods related thereto | 美国陶氏益农公司 | 2019-07-19 | — | — | CN | disclosed |
| CN-109686870-A | Isotope composition, electroluminescent organic material, organic electroluminescence device, electronic equipment | 北京诚志永华显示科技有限公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-105408322-B | Terazololine-one compound and application thereof | 住友化学株式会社 | 2019-04-19 | — | — | CN | disclosed |
| CN-109456253-A | A kind of method of chiral induction synthesis (S) -3- (4- bromophenyl)-piperidines or its salt | 上海博璞诺科技发展有限公司 | 2019-03-12 | — | — | CN | disclosed |
| CN-103562210-B | PI3K 110 δ are had to optionally benzo oxygen azepine * compound and using method | F. HOFFMANN-LA ROCHE AG (CH) | 2016-05-25 | — | — | CN | disclosed |
| WO-2015073864-A1 | EBNA1 INHIBITORS AND THEIR METHOD OF USE | THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) | 2015-05-21 | — | — | WO | disclosed |
| EP-2852284-A2 | PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO | Dow AgroSciences LLC (US) | 2015-04-01 | — | — | EP | disclosed |
| WO-2013162715-A2 | PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2013-10-31 | — | — | WO | disclosed |
| CN-101094829-A | Novel anthranilic acid derivative or salt thereof | TOYAMA CHEMICAL CO LTD (JP) | 2007-12-26 | — | — | CN | disclosed |
| EP-1732566-A2 | 6-AZAINDOLE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005097129-A2 | 6-AZAINDOLE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-10-20 | — | — | WO | disclosed |
| US-6573275-B1 | Insecticidal compositions comprising and to methods of combatting and controlling insect pests therewith. | SYNGENTA LIMITED (GB) | 2003-06-03 | — | — | US | disclosed |
| US-6391883-B1 | INSECTICIDES | SYNGENTA LIMITED (GB) | 2002-05-21 | — | — | US | disclosed |