Known targets — ChEMBL curated mechanism
ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CALCRLCHRM1CHRM2CHRM3F2RMAOAMAOBMAP2K1MAP2K2NTRK1NTRK2NTRK3OPRD1OPRK1OPRM1P2RY12PKLRSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASLC18A2SLC6A2SLC6A3TLR7TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8dacAdacBdacCfolAftsImrcAmrcBmrdApolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmB1rpmB2rpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmHrpmIrpmJrpmJ2rpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsR1rpsR2rpsSrpsTrpsUrpsZykgMykgO
The experimentally established mechanism targets of Toluene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.61 |
| ▸ | ACHE | P22303 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
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 SCHEMBL2904564 | 1.00 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL248686 | 0.97 | LMNA (0.65) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL11123126 | 0.97 | LMNA (0.65) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL5070324 | 0.94 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL28219186 | 0.94 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL6518753 | 0.94 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL3973760 | 0.94 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL28004549 | 0.94 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL7627695 | 0.94 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL27784842 | 0.94 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106318145-B | A kind of polyester-type water-based emulsion, preparation method and applications | 中国乐凯集团有限公司 | 2019-02-01 | — | — | CN | claimed |
| CN-106318145-A | Polyester type water-borne emulsion, preparing method and application thereof | 中国乐凯集团有限公司 | 2017-01-11 | — | — | CN | claimed |
| CN-104151589-A | Method for preparing low-haze polyester film | SUZHOU XILIN OPTOELECTRONICS TECHNOLOGY INDUSTRY CO LTD | 2014-11-19 | — | — | CN | claimed |
| CN-112778475-B | Phenolic resin for aqueous adhesive and preparation method thereof | ＫＣＣ公司 | 2023-12-29 | — | — | CN | disclosed |
| CN-116410505-A | Printable substrate and coating composition for printing | 南亚塑胶工业股份有限公司 | 2023-07-11 | — | — | CN | disclosed |
| US-20230203333-A1 | PRINTABLE SUBSTRATE AND COATING COMPOSITION FOR PRINTING | NAN YA PLASTICS CORPORATION (TW) | 2023-06-29 | — | — | US | disclosed |
| CN-113337190-A | Surface coating liquid composition and polyester film structure | 南亚塑胶工业股份有限公司 | 2021-09-03 | — | — | CN | disclosed |
| CN-108424713-B | Surfactant for workpiece, preparation method and workpiece surface spraying type pretreatment method | 佛山科富科技有限公司 | 2020-07-28 | — | — | CN | disclosed |
| CN-106318145-B | A kind of polyester-type water-based emulsion, preparation method and applications | 中国乐凯集团有限公司 | 2019-02-01 | — | — | CN | disclosed |
| CN-108504067-A | A kind of computer keyboard high fire-retardance composite material and preparation method | 合肥酷睿网络科技有限公司 | 2018-09-07 | — | — | CN | disclosed |
| CN-108504067-A | A kind of computer keyboard high fire-retardance composite material and preparation method | 合肥酷睿网络科技有限公司 | 2018-09-07 | — | — | CN | disclosed |
| CN-108424713-A | Workpiece interfacial agent, preparation method and workpiece surface spray soak method | 佛山科富科技有限公司 | 2018-08-21 | — | — | CN | disclosed |
| CN-106726712-A | A kind of maintenance shampoo | 钟梅 | 2017-05-31 | — | — | CN | disclosed |
| CN-106318145-A | Polyester type water-borne emulsion, preparing method and application thereof | 中国乐凯集团有限公司 | 2017-01-11 | — | — | CN | disclosed |
| CN-104151589-A | Method for preparing low-haze polyester film | SUZHOU XILIN OPTOELECTRONICS TECHNOLOGY INDUSTRY CO LTD | 2014-11-19 | — | — | CN | disclosed |
| CN-101134865-B | Aqueous coating liquid composition for optical polyester film | NANYA PLASTICS CORP | 2010-05-26 | — | — | CN | disclosed |
| EP-1088012-B1 | FIBER GLASS BINDER COMPOSITIONS AND PROCESS THEREFOR | KNAUF FIBER GLASS GMBH (US) | 2010-04-14 | — | — | EP | disclosed |
| CN-101134865-A | Aqueous coating liquid composition for optical polyester film | NANYA PLASTICS CORP (CN) | 2008-03-05 | — | — | CN | disclosed |
| US-6638882-B1 | Coating glass fiber with resole resin binder composition including catalyst comprising salt formed from ammonia and arylsulfonic acid, heating and compressing to produce molded fiber glass composition having enhanced thermal stability | KNAUF FIBER GLASS GMBH | 2003-10-28 | — | — | US | disclosed |
| US-6555616-B1 | Binder of an aqueous solution of a resole resin, a catalyst of an ammonia salt of an aryl sulfonic acid , and binder modifiers; shorter cure rate | KNAUF FIBER GLASS GMBH | 2003-04-29 | — | — | US | disclosed |