Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | NPY2R | P49146 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11724581 | 0.82 | CYP2C19 (0.47) | CYP2D6CYP2C19KMT2AMEN1CYP2C9 | |
| SCHEMBL4673742 | 0.82 | TAAR1 (0.52) | CYP2D6CYP2C19KMT2AMEN1CYP2C9 | |
| SCHEMBL955513 | 0.78 | CYP2C19 (0.42) | CYP2D6CYP2C19KMT2ACYP2C9TAAR1 | |
| SCHEMBL9398476 | 0.78 | ESR1 (0.50) | KMT2AMEN1CYP3A4ALDH1A1ESR1 | |
| SCHEMBL11421695 | 0.78 | TAAR1 (0.43) | CYP2D6CYP2C19KMT2AMEN1CYP2C9 | |
| SCHEMBL30338404 | 0.78 | MAPT (0.39) | CYP2D6CYP2C19KMT2AMEN1CYP2C9 | |
| SCHEMBL31310650 | 0.78 | CYP2C19 (0.42) | CYP2D6CYP2C19KMT2ACYP2C9TAAR1 | |
| SCHEMBL30338355 | 0.78 | CYP2A6 (0.33) | CYP2D6CYP2C19KMT2AMEN1CYP2C9 | |
| SCHEMBL5180038 | 0.77 | CYP2C19 (0.49) | CYP2D6CYP2C19KMT2AMEN1CYP2C9 | |
| SCHEMBL27819578 | 0.77 | ALDH1A1 (0.50) | CYP2D6CYP2C19KMT2AMEN1CYP2C9 |
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-103242214-B | A kind of indole derivatives and preparation method thereof | SHAANXI BUCHANG HIGH-TECH PHARMACEUTICAL CO., LTD. (CN) | 2016-04-06 | — | — | CN | claimed |
| CN-103641938-B | A kind of initiator that can be used for vinyl monomer polyreaction | BEIJING UNIVERSITY OF CHEMICAL TECHNOLOGY (CN) | 2015-10-28 | — | — | CN | claimed |
| CN-104668552-B | A kind of aluminium powder for 3D printing and preparation method thereof | 成都新柯力化工科技有限公司 | 2016-09-07 | — | — | CN | disclosed |
| CN-103242214-B | A kind of indole derivatives and preparation method thereof | SHAANXI BUCHANG HIGH-TECH PHARMACEUTICAL CO., LTD. (CN) | 2016-04-06 | — | — | CN | disclosed |
| CN-105348564-A | Preparation method of inorganic powder specially used for low-density composite ivory boards | CHENGDU NEW KELI CHEM SCI CO | 2016-02-24 | — | — | CN | disclosed |
| CN-103772286-B | A kind of method preparing imidafenacin | JIANGXI QINGFENG PHARMACEUTICAL CO., LTD. (CN) | 2016-01-13 | — | — | CN | disclosed |
| CN-103772286-B | A kind of method preparing imidafenacin | JIANGXI QINGFENG PHARMACEUTICAL CO., LTD. (CN) | 2016-01-13 | — | — | CN | disclosed |
| CN-103641938-B | A kind of initiator that can be used for vinyl monomer polyreaction | BEIJING UNIVERSITY OF CHEMICAL TECHNOLOGY (CN) | 2015-10-28 | — | — | CN | disclosed |
| CN-104668552-A | Aluminum powder for 3D (three-dimensional) printing and preparation method of aluminum powder | CHENGDU NEW KELI CHEM SCI CO | 2015-06-03 | — | — | CN | disclosed |
| US-7169924-B2 | Pyrimidinone derivatives and their use in the treatment of atherosclerosis | SMITHKLINE BEECHAM PLC (GB) | 2007-01-30 | — | — | US | disclosed |
| EP-0892787-A1 | NOVEL $g(a)-HYDROXYLIC ACID DERIVATIVES, THEIR PRODUCTION AND USE | BASF AKTIENGESELLSCHAFT (DE) | 1999-01-27 | — | — | EP | disclosed |
| WO-1997038981-A1 | NOVEL α-HYDROXYLIC ACID DERIVATIVES, THEIR PRODUCTION AND USE | BASF AKTIENGESELLSCHAFT (DE) | 1997-10-23 | — | — | WO | disclosed |
| US-5266718-A | Antidiabetic agents | ADIR ET COMPAGNIE (FR) | 1993-11-30 | — | — | US | disclosed |
| EP-0518769-A1 | Ethanolaminebenzoate derivative, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1992-12-16 | — | — | EP | disclosed |