Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Benzene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 known ✓ | O43570 | 2/20 | 0.36 |
| ▸ | CA2 known ✓ | P00918 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL630833 | 0.97 | CA12 (0.34) | CA12CA2CA9MEN1ALDH1A1 | |
| SCHEMBL10445874 | 0.89 | — | — | |
| Lithium Ion SCHEMBL21753847 | 0.82 | — | — | |
| Potassium Ion SCHEMBL21753862 | 0.82 | — | — | |
| Toluene SCHEMBL7188331 | 0.81 | LMNA (0.48) | CA12CA2CA9MEN1ALDH1A1 | |
| Benzene SCHEMBL6886142 | 0.73 | TSHR (0.46) | CA12CA2CA9MEN1ALDH1A1 | |
| Benzene SCHEMBL1584200 | 0.73 | TSHR (0.46) | CA12CA2CA9MEN1ALDH1A1 | |
| Benzene SCHEMBL3130121 | 0.69 | TSHR (0.36) | CA2ALDH1A1TSHR | |
| Benzene SCHEMBL7603410 | 0.69 | CA1 (0.43) | CA12CA2CA9ALDH1A1 | |
| Benzene SCHEMBL5664348 | 0.67 | MEN1 (0.40) | CA12CA2CA9MEN1ALDH1A1 |
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 195 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401001-A1 | ANTI- INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME | Orthobond Corp. (US) | 2012-01-04 | — | — | EP | claimed |
| WO-2010099221-A1 | ANTI- INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME | ORTHOBOND CORP. (US) | 2010-09-02 | — | — | WO | claimed |
| US-20100215643-A1 | ANTI-INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME | ORTHOBOND CORP. (US) | 2010-08-26 | — | — | US | claimed |
| US-4565787-A | N-HALOGENO-N-METAL ARYSULFONAMIDATES | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1986-01-21 | — | — | US | claimed |
| JP-54060352-A | — | — | None | — | — | JP | disclosed |
| US-20240141370-A1 | AGRICULTURAL COMPOSITIONS AND RELATED METHODS | FLAGSHIP PIONEERING INNOVATIONS VI LLC (US) | 2024-05-02 | — | — | US | disclosed |
| EP-4355890-A1 | MODIFICATION OF PLANT MESSENGER PACKS | Flagship Pioneering Innovations VI, LLC (US) | 2024-04-24 | — | — | EP | disclosed |
| EP-2865743-B1 | Improvements in dispensing devices | RECKITT BENCKISER LLC (US) | 2024-03-27 | — | — | EP | disclosed |
| WO-2024046834-A1 | ANTIOXIDANT COMPOSITION COMPRISING 5-DEOXYFLAVONOIDS | ANALYTICON DISCOVERY GMBH (DE) | 2024-03-07 | — | — | WO | disclosed |
| EP-4331564-A1 | ANTIOXIDANT COMPOSITION COMPRISING 5-DEOXYFLAVONOIDS | Analyticon Discovery GmbH (DE) | 2024-03-06 | — | — | EP | disclosed |
| US-11827897-B2 | Agricultural compositions and related methods | FLAGSHIP PIONEERING INNOVATIONS VI, LLC (US) | 2023-11-28 | — | — | US | disclosed |
| WO-2023096858-A1 | A BACTERIA-DERIVED LIPID COMPOSITION AND USE THEREOF | SENDA BIOSCIENCES, INC. (US) | 2023-06-01 | — | — | WO | disclosed |
| EP-1961301-A1 | Biocide compositions comprising a dialkylamide of a hydroxycarboxylic acid | Cognis IP Management GmbH (DE) | 2008-08-27 | — | — | EP | disclosed |
| EP-1961302-A1 | Biocide compositions comprising at least one dialkylamide based on oleic or linoleic acid | Cognis IP Management GmbH (DE) | 2008-08-27 | — | — | EP | disclosed |
| WO-2007107769-A1 | IMPROVEMENTS IN LAVATORY DISPENSING DEVICES | RECKITT BENCKISER INC. (US) | 2007-09-27 | — | — | WO | disclosed |
| US-6245361-B1 | APPLYING SURFACE AN AQUEOUS SOLUTION OF A SYNERGISTIC MIXTURE OF CHLORINE BLEACH AND BACTERICIDE | S. C. JOHNSON COMMERCIAL MARKETS, INC. | 2001-06-12 | — | — | US | disclosed |
| EP-0844827-B1 | TUBERCULOCIDAL SYNERGISTIC DISINFECTANT COMPOSITIONS AND METHODS OF DISINFECTING | JOHNSON S C COMM MARKETS INC (US) | 1999-06-09 | — | — | EP | disclosed |
| US-4565787-A | N-HALOGENO-N-METAL ARYSULFONAMIDATES | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1986-01-21 | — | — | US | disclosed |
| JP-S5460352-A | POLYCARBONATE RESIN COMPOSITION | TEIJIN CHEM LTD | 1979-05-15 | — | — | JP | disclosed |
| US-3943243-A | SODIUM BISULFATE, P-DICHLORO-BENZENE OR NAPHTHALENE | E. I. DU PONT DE NEMOURS AND CO. (US) | 1976-03-09 | — | — | US | disclosed |