Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Toluene SCHEMBL27502958 | 0.89 | LMNA (0.46) | CYP3A4TDP1LOXL2TAAR1CYP2A6 | |
| SCHEMBL27587243 | 0.76 | TDP1 (0.43) | CYP3A4TDP1ALDH1A1HPGDTSHR | |
| SCHEMBL2155208 | 0.74 | CYP3A4 (0.41) | CYP3A4TDP1CYP1A2KDM4EMEN1 | |
| SCHEMBL28501854 | 0.73 | MAOA (0.42) | HTR2AHRH1MAOA | |
| SCHEMBL2329641 | 0.72 | CYP3A4 (0.45) | CYP3A4TDP1LOXL2TAAR1HTR2A | |
| SCHEMBL28443365 | 0.72 | TSHR (0.40) | CYP3A4TDP1LOXL2ALDH1A1HPGD | |
| SCHEMBL27897907 | 0.70 | CYP3A4 (0.43) | CYP3A4TDP1LOXL2TAAR1HTR2A | |
| SCHEMBL27822953 | 0.70 | AKR1B1 (0.41) | CYP3A4TDP1SMN1; SMN2KDM4EMEN1 | |
| SCHEMBL5572991 | 0.70 | TDP1 (0.38) | CYP3A4TDP1SMN1; SMN2KDM4EMEN1 | |
| SCHEMBL28050880 | 0.69 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103275124-B | A kind of Alkyl phosphine oxide silane coupling agent and preparation method thereof | TSINGHUA UNIVERSITY (CN) | 2016-02-10 | — | — | CN | claimed |
| CN-110462867-A | Organic electroluminescent device | KONICA MINOLTA INC | 2019-11-15 | — | — | CN | disclosed |
| CN-109315046-A | The manufacturing method and organic electroluminescent device of organic electroluminescent device | 柯尼卡美能达株式会社 | 2019-02-05 | — | — | CN | disclosed |
| CN-108369995-A | Organic electroluminescent device, the manufacturing method of organic electroluminescent device, display device, lighting device and organic electroluminescent device material | 柯尼卡美能达株式会社 | 2018-08-03 | — | — | CN | disclosed |
| CN-108026122-A | The method for preparing phosphorous cyanhydrin ester | 拜耳作物科学股份公司 | 2018-05-11 | — | — | CN | disclosed |
| CN-107922447-A | The method for preparing phosphorous cyanhydrin ester | 拜耳作物科学股份公司 | 2018-04-17 | — | — | CN | disclosed |
| CN-106459110-A | Process for preparing phosphorus-containing cyanohydrins | 拜耳作物科学股份公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-103259044-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery | MITSUBISHI CHEMICAL CORP. (JP) | 2016-02-10 | — | — | CN | disclosed |
| CN-103275124-B | A kind of Alkyl phosphine oxide silane coupling agent and preparation method thereof | TSINGHUA UNIVERSITY (CN) | 2016-02-10 | — | — | CN | disclosed |
| CN-102097654-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery | MITSUBISHI CHEMICAL CORP. (JP) | 2014-10-01 | — | — | CN | disclosed |
| CN-103275124-A | Alkyl phosphine oxide silane coupling agent and preparation method | UNIV TSINGHUA | 2013-09-04 | — | — | CN | disclosed |
| CN-103259044-A | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery | MITSUBISHI CHEM CORP | 2013-08-21 | — | — | CN | disclosed |
| CN-101432923-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery | MITSUBISHI CHEM CORP | 2012-04-18 | — | — | CN | disclosed |
| CN-102097654-A | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery | MITSUBISHI CHEM CORP | 2011-06-15 | — | — | CN | disclosed |
| CN-101432923-A | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery | MITSUBISHI CHEM CORP (JP) | 2009-05-13 | — | — | CN | disclosed |