Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.60 |
| ▸ | CES1 | P23141 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.46 |
| ▸ | FEN1 | P39748 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL29952517 | 1.00 | CES2 (0.60) | CES2CES1ALDH1A1POLBPTGS1 | |
| Water SCHEMBL10353121 | 0.98 | CES2 (0.58) | CES2CES1ALDH1A1POLBPTGS1 | |
| SCHEMBL420969 | 0.83 | ALDH1A1 (0.59) | CES2CES1ALDH1A1MAPK1TDP1 | |
| SCHEMBL2652860 | 0.83 | ALDH1A1 (0.50) | CES2CES1ALDH1A1POLBRAB9A | |
| SCHEMBL8723935 | 0.83 | TSHR (0.61) | CES2CES1ALDH1A1POLBMAPK1 | |
| SCHEMBL9113114 | 0.80 | CES2 (0.58) | CES2CES1ALDH1A1POLBPTGS1 | |
| SCHEMBL7006496 | 0.80 | CES2 (0.58) | CES2CES1ALDH1A1POLBPTGS1 | |
| SCHEMBL7829063 | 0.80 | CES2 (0.58) | CES2CES1ALDH1A1POLBPTGS1 | |
| SCHEMBL4770585 | 0.80 | CES2 (0.58) | CES2CES1ALDH1A1POLBPTGS1 | |
| SCHEMBL2865994 | 0.79 | CYP1A2 (0.50) | CES2CES1ALDH1A1POLBRAB9A |
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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104945209-B | A kind of synthetic method of 2-aminobutene 1,4-derovatives | 常州大学 | 2016-06-29 | — | — | CN | claimed |
| CN-104945209-A | Synthesizing method for 2-amino butene 1,4-diketone derivative | UNIV CHANGZHOU | 2015-09-30 | — | — | CN | claimed |
| JP-2011526813-A | — | — | 2011-10-20 | — | — | JP | claimed |
| EP-2310068-A2 | NANOCLAY SORBENTS FOR DIALYSIS DEVICE | Baxter International Inc. (US) | 2011-04-20 | — | — | EP | claimed |
| US-20100004588-A1 | NANOCLAY SORBENTS FOR DIALYSIS | BAXTER INTERNATIONAL INC. (US) | 2010-01-07 | — | — | US | claimed |
| WO-2010002830-A2 | NANOCLAY SORBENTS FOR DIALYSIS DEVICE | BAXTER INTERNATIONAL INC. (US) | 2010-01-07 | — | — | WO | claimed |
| CN-116496151-A | Method for preparing fluorenone derivative by using Catellani strategy | 长沙医学院 | 2023-07-28 | — | — | CN | disclosed |
| CN-110143886-B | Process for the preparation of beta-arylaminoalkols such as tulobuterol, chlorpropaline, isoadrenaline dichloride and sotalol | 北京化工大学 | 2022-11-01 | — | — | CN | disclosed |
| CN-114689737-A | Analysis method of S-o-chlorophenyl glycine methyl ester tartrate related substances | 浙江车头制药股份有限公司 | 2022-07-01 | — | — | CN | disclosed |
| EP-3640247-B1 | SYK INHIBITOR AND USE METHOD THEREFOR | CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) | 2022-01-12 | — | — | EP | disclosed |
| US-20210353840-A1 | NANOCLAY SORBENT METHODS FOR USE WITH DIALYSIS | VANTIVE US HEALTHCARE LLC | 2021-11-18 | — | — | US | disclosed |
| CN-111205194-A | Preparation method of tulobuterol | 山东达因海洋生物制药股份有限公司 | 2020-05-29 | — | — | CN | disclosed |
| EP-3640247-A1 | SYK INHIBITOR AND USE METHOD THEREFOR | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2020-04-22 | — | — | EP | disclosed |
| EP-0019411-B1 | 1-PHENYL-2-AMINOETHANOL DERIVATIVES, PROCESSES FOR THEIR MANUFACTURE AND PHARMACEUTICAL COMPOSITIONS THEREOF | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1982-12-22 | — | — | EP | disclosed |
| US-4323575-A | TOPICAL ANTIINFLAMMATORY AGENTS | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1982-04-06 | — | — | US | disclosed |
| EP-0019411-A1 | 1-Phenyl-2-aminoethanol derivatives, processes for their manufacture and pharmaceutical compositions thereof | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1980-11-26 | — | — | EP | disclosed |
| EP-0006735-A1 | Secondary amines, their preparation, pharmaceutical compositions containing them and their use | BEECHAM GROUP PLC (GB) | 1980-01-09 | — | — | EP | disclosed |
| US-4159375-A | 6- AND 7-Aryl-1,2,4-triazolo[4,3-b]-1,2,4-triazines | AMERICAN CYANAMID COMPANY (US) | 1979-06-26 | — | — | US | disclosed |
| US-4046763-A | INTERMEDIATE FOR ULTRAVIOLET LIGHT ABSORBERS | MCNEIL LABORATORIES, INCORPORATED (US) | 1977-09-06 | — | — | US | disclosed |
| US-4018818-A | Hydroxyl-substituted 2-chloro-α-(tert-butylaminomethyl)-benzylalcohols | HOKURIKU PHARMACEUTICAL CO., LTD. (JA) | 1977-04-19 | — | — | US | disclosed |