Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 4/20 | 0.48 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | CA12 | O43570 | 3/20 | 0.48 |
| ▸ | CA7 | P43166 | 3/20 | 0.48 |
| ▸ | CA9 | Q16790 | 3/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | TYR | P14679 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL27685854 | 0.83 | PDPK1 (0.87) | PDPK1LMNAESR1ESR2MAPT | |
| SCHEMBL9823838 | 0.81 | CES2 (0.54) | PDPK1LMNAMAPTHTTCA1 | |
| SCHEMBL27482058 | 0.79 | PDPK1 (0.61) | PDPK1LMNAESR1ESR2MAPT | |
| SCHEMBL2849585 | 0.78 | CES1 (0.58) | LMNAMAPTHPGDCA1CA2 | |
| SCHEMBL11833914 | 0.77 | PDPK1 (0.59) | PDPK1LMNAESR1ESR2MAPT | |
| Phosphine SCHEMBL27941168 | 0.76 | CES1 (0.56) | LMNAMAPTHPGDCA1CA2 | |
| SCHEMBL481087 | 0.76 | CA1 (0.52) | PDPK1LMNAESR1ESR2MAPT | |
| SCHEMBL27898502 | 0.76 | CA1 (0.54) | PDPK1LMNAESR1ESR2MAPT | |
| SCHEMBL8982949 | 0.76 | PDPK1 (0.57) | PDPK1LMNAESR1ESR2MAPT | |
| SCHEMBL10846565 | 0.76 | PDPK1 (0.57) | PDPK1LMNAESR1ESR2MAPT |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106431865-A | Synthetic method of isoproterenol drug intermediate 2,4-dyhydroxy-alpha-chloroacetophenone | 厦门安普顿信息科技有限公司 | 2017-02-22 | — | — | CN | claimed |
| CN-105439842-A | Synthesis method of isoprenaline drug intermediate 2,4-dihydroxy-alpha-chloroacetophenone | CHENGDU CARDIFF SCIENCE AND TECH CO LTD | 2016-03-30 | — | — | CN | claimed |
| CN-106431865-A | Synthetic method of isoproterenol drug intermediate 2,4-dyhydroxy-alpha-chloroacetophenone | 厦门安普顿信息科技有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-106431865-A | Synthetic method of isoproterenol drug intermediate 2,4-dyhydroxy-alpha-chloroacetophenone | 厦门安普顿信息科技有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-106431865-A | Synthetic method of isoproterenol drug intermediate 2,4-dyhydroxy-alpha-chloroacetophenone | 厦门安普顿信息科技有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-103724269-B | Phenyl 1, 2-isoxazole or phenyl 1, 2-pyrazole compound and application thereof | 中国科学院上海药物研究所 | 2016-12-21 | — | — | CN | disclosed |
| CN-104072455-B | 6-aroyl acetyl oxygen base Aurone compound and the application on pesticide thereof | 江苏大学 | 2016-06-15 | — | — | CN | disclosed |
| CN-105439842-A | Synthesis method of isoprenaline drug intermediate 2,4-dihydroxy-alpha-chloroacetophenone | CHENGDU CARDIFF SCIENCE AND TECH CO LTD | 2016-03-30 | — | — | CN | disclosed |
| CN-105439842-A | Synthesis method of isoprenaline drug intermediate 2,4-dihydroxy-alpha-chloroacetophenone | CHENGDU CARDIFF SCIENCE AND TECH CO LTD | 2016-03-30 | — | — | CN | disclosed |
| CN-105439842-A | Synthesis method of isoprenaline drug intermediate 2,4-dihydroxy-alpha-chloroacetophenone | CHENGDU CARDIFF SCIENCE AND TECH CO LTD | 2016-03-30 | — | — | CN | disclosed |
| CN-104072455-A | 6-aryloxy acetoxy aurone compound and application thereof on pesticide | UNIV JIANGSU | 2014-10-01 | — | — | CN | disclosed |
| CN-103724269-A | Phenyl 1, 2-isoxazole or phenyl 1, 2-pyrazole compound and application thereof | SHANGHAI INST MATERIA MEDICA | 2014-04-16 | — | — | CN | disclosed |
| CN-1475487-A | Fluoro flavon containing compound, manufacturing method and its use | 东华大学 | 2004-02-18 | — | — | CN | disclosed |
| EP-0545682-A2 | Process for preparing alpha-chloro-alpha-oximino-4-hydroxyacetophenone | HOECHST CELANESE CORPORATION (US) | 1993-06-09 | — | — | EP | disclosed |