Benzene

Benzene

SCHEMBL27415869

Br.Br.C=C.c1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

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 2)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50

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.

Compoundsimilaritytop predictedshared targets
Benzene SCHEMBL27460483 1.00 TP53 (0.50) TP53TSHR
Benzene SCHEMBL27281331 1.00 TP53 (0.50) TP53TSHR
Benzene SCHEMBL27282259 0.91 TP53 (0.60) TP53TSHR
Benzene SCHEMBL333452 0.91 TP53 (0.60) TP53TSHR
Benzene SCHEMBL264923 0.91
Benzene SCHEMBL27261994 0.83 TP53 (0.50) TP53TSHR
Benzene SCHEMBL27636032 0.83
Benzene SCHEMBL6932338 0.83 TP53 (0.50) TP53TSHR
Benzene SCHEMBL27747038 0.83 TP53 (0.50) TP53TSHR
Benzene SCHEMBL27316894 0.83

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101713107-A High-temperature flame retardant fibers for wig QIANG LUO 2010-05-26 CN claimed
CN-104115236-B Composition and the conductor formed by it 道康宁公司 2017-12-19 CN disclosed
CN-106117409-A A kind of preparation method of brominated polystyrene 山东大学 2016-11-16 CN disclosed
CN-104321883-A Photovoltaic cell and method of forming the same DOW CORNING 2015-01-28 CN disclosed
CN-104126230-A Photovoltaic cell and article including isotropic or anisotropic electrically conductive layer DOW CORNING 2014-10-29 CN disclosed
CN-104115236-A COMPOSITION AND CONDUCTOR FORMED THEREFROM DOW CORNING 2014-10-22 CN disclosed
CN-104115277-A Photovoltaic cell and method of forming the same DOW CORNING 2014-10-22 CN disclosed
CN-101802655-B Resin composition for light diffusion plate, light diffusion plate and method for producing same DAINIPPON INK & CHEMICALS 2012-01-04 CN disclosed
CN-101802655-A Resin composition for light diffusion plate, light diffusion plate and method for producing same DAINIPPON INK & CHEMICALS 2010-08-11 CN disclosed
CN-1090864-A Flame retardant brominated styrene graft latex compositions GREAT LAKES CHEMICAL CORP (US) 1994-08-17 CN disclosed
CN-1089976-A Flame retardant brominated styrene graft latex compositions GREAT LAKES CHEMICAL CORP (US) 1994-07-27 CN disclosed