Styrene

Styrene

SCHEMBL28057586

C=C.C=C(C)C(=O)O.C=CC(=O)OC(C)(C)C.C=Cc1ccccc1.O

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Styrene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 known ✓ P0DMS8 1/20 0.34
SLC6A2 known ✓ P23975 1/20 0.34
DRD3 known ✓ P35462 1/20 0.34
OPRK1 known ✓ P41145 1/20 0.34
PDE4D known ✓ Q08499 1/20 0.34
THRB known ✓ P10828 2/20 0.33
PTGS2 known ✓ P35354 1/20 0.32
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
AKR1C3 P42330 1/20 0.36
CYP2C19 P33261 3/20 0.35
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34
HTT P42858 2/20 0.34
LMNA P02545 1/20 0.34
NR1I2 O75469 1/20 0.34
PGR P06401 1/20 0.34
TBXAS1 P24557 1/20 0.34
KCNH2 Q12809 1/20 0.34
NFKB1 P19838 1/20 0.34

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
Styrene SCHEMBL28822311 0.97 ALDH1A1 (0.41) ALDH1A1TSHRAKR1C3CYP2C19CYP3A4
Styrene SCHEMBL27995856 0.91 ALDH1A1 (0.36) ALDH1A1TSHRAKR1C3CYP2C19CYP3A4
Styrene SCHEMBL5008696 0.90 ALDH1A1 (0.48) ALDH1A1TSHRAKR1C3CYP2C19CYP3A4
Styrene SCHEMBL6903124 0.90 ALDH1A1 (0.48) ALDH1A1TSHRAKR1C3CYP2C19CYP3A4
Styrene SCHEMBL27545176 0.87 ALDH1A1 (0.45) ALDH1A1TSHRCYP2C19CYP3A4CYP2C9
Styrene SCHEMBL27567078 0.86 ALDH1A1 (0.40) ALDH1A1TSHRCYP2C19CYP3A4CYP2C9
Styrene SCHEMBL27544630 0.86 ALDH1A1 (0.39) ALDH1A1TSHRCYP2C19CYP2C9NFKB1
Styrene SCHEMBL28844457 0.84 ALDH1A1 (0.40) ALDH1A1TSHRCYP2C19CYP3A4CYP2C9
Styrene SCHEMBL27546864 0.84 ALDH1A1 (0.38) ALDH1A1TSHRCYP2C19CYP3A4CYP2C9
Styrene SCHEMBL28947330 0.84 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105319908-A IMAGE FORMING APPARATUS AND PROCESS CARTRIDGE RICOH KK 2016-02-10 CN disclosed