Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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.
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 SCHEMBL7645369 | 0.92 | — | — | |
| Toluene SCHEMBL27963691 | 0.92 | ACHE (0.85) | — | |
| Toluene SCHEMBL27531377 | 0.92 | ACHE (0.85) | — | |
| Toluene SCHEMBL3632660 | 0.92 | — | — | |
| Toluene SCHEMBL17825900 | 0.92 | — | — | |
| Toluene SCHEMBL28094531 | 0.92 | — | — | |
| Toluene SCHEMBL9806869 | 0.92 | — | — | |
| Toluene SCHEMBL28296994 | 0.92 | — | — | |
| Toluene SCHEMBL175861 | 0.92 | ACHE (1.00) | — | |
| SCHEMBL12344943 | 0.92 | ACHE (1.00) | — |
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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117264534-B | Antibacterial and antifouling furniture board and manufacturing process thereof | 上海拉迷家具有限公司 | 2024-10-18 | — | — | CN | claimed |
| CN-117264534-A | Antibacterial and antifouling furniture board and manufacturing process thereof | 上海拉迷家具有限公司 | 2023-12-22 | — | — | CN | claimed |
| CN-107022074-A | It is a kind of chiral poly-（Decanedioyl base glycerol diester）Preparation method | 东华大学 | 2017-08-08 | — | — | CN | claimed |
| EP-1614677-B1 | Improved procedure for the synthesis of bicalutamide | COSMA S P A (IT) | 2009-08-05 | — | — | EP | claimed |
| US-20060041161-A1 | Procedure for the synthesis of bicalutamide | COSMA S.P.A. (IT) | 2006-02-23 | — | — | US | claimed |
| EP-1614677-A2 | Improved procedure for the synthesis of bicalutamide | Cosma S.p.A. (IT) | 2006-01-11 | — | — | EP | claimed |
| CN-117264534-B | Antibacterial and antifouling furniture board and manufacturing process thereof | 上海拉迷家具有限公司 | 2024-10-18 | — | — | CN | disclosed |
| CN-117264534-A | Antibacterial and antifouling furniture board and manufacturing process thereof | 上海拉迷家具有限公司 | 2023-12-22 | — | — | CN | disclosed |
| CN-113861158-B | Method for synthesizing methyl diene diketone key intermediate | 湖南新合新生物医药有限公司 | 2023-02-10 | — | — | CN | disclosed |
| CN-113861158-A | Method for synthesizing methyl diene diketone key intermediate | 湖南新合新生物医药有限公司 | 2021-12-31 | — | — | CN | disclosed |
| CN-109796331-A | A method of 3,5- di-tert-butyl-4-hydroxybenzoic acid is prepared with single solvent | 甘肃省化工研究院有限责任公司 | 2019-05-24 | — | — | CN | disclosed |
| CN-109534982-A | A kind of production method of 3,5- di-tert-butyl-4-hydroxybenzoic acid | 甘肃省化工研究院有限责任公司 | 2019-03-29 | — | — | CN | disclosed |
| CN-105481684-B | A kind of method of asymmetric synthesis by Arteannuic acid to dihydroartemisinic acid | 上海交通大学 | 2019-03-01 | — | — | CN | disclosed |
| US-5292887-A | Antgonists at postsynoptic adrenoreceptors; hypotensive and antidiabetic agents | FARMOS-YHTYMA OY (FI) | 1994-03-08 | — | — | US | disclosed |
| CN-1023219-C | Substituted imidazole derivatives and their preparation and use | FARMOS OY (FI) | 1993-12-22 | — | — | CN | disclosed |
| CN-1043128-A | The imdazole derivatives and the preparation thereof that replace | FARMOS OY (FI) | 1990-06-20 | — | — | CN | disclosed |
| EP-0372954-A1 | Substituted imidazole derivatives and their preparation and use | ORION-YHTYMÀ OY (FI) | 1990-06-13 | — | — | EP | disclosed |
| US-4910200-A | Agricultural fungicide | CELAMERCK GMBH & CO. KG (DE) | 1990-03-20 | — | — | US | disclosed |
| US-4748276-A | Process for preparing N,N-bis(2-hydroxyethyl)benzylamine and N,N-bis(2-chloroethyl)benzylamine | STERLING DRUG INC. (US) | 1988-05-31 | — | — | US | disclosed |
| US-4010207-A | Process for the alkylation of α, β-unsaturated aldehydes | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-03-01 | — | — | US | disclosed |