Naphthoquinone

Naphthoquinone

SCHEMBL722080

O.O=C1C=CC(=O)c2ccccc21

nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Naphthoquinone. 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
MEN1 known ✓ O00255 7/20 0.52
THRB known ✓ P10828 3/20 0.52
ACHE known ✓ P22303 1/20 0.52
TOP1 known ✓ P11387 3/20 0.48
ADORA3 known ✓ P0DMS8 1/20 0.44
GSK3B known ✓ P49841 1/20 0.43
IDO1 P14902 6/20 0.93
CDC25B P30305 5/20 0.93
MAOA P21397 3/20 0.93
PIN1 Q13526 2/20 0.93
EHMT2 Q96KQ7 2/20 0.93
MAOB P27338 2/20 0.93
SNCA P37840 2/20 0.93
AKT1 P31749 1/20 0.93
MAP2K1 Q02750 1/20 0.93
NSD1 Q96L73 1/20 0.93
EHMT1 Q9H9B1 1/20 0.93
KMT2A Q03164 7/20 0.52
ALDH1A1 P00352 6/20 0.52
MAPT P10636 5/20 0.52

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
Naphthoquinone SCHEMBL31053994 1.00 IDO1 (0.93) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL459083 1.00 IDO1 (0.93) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL9165462 0.97 IDO1 (0.88) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL8861335 0.97 IDO1 (1.00) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL11359780 0.97 IDO1 (1.00) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL42139 0.97 IDO1 (1.00) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL29354680 0.97 IDO1 (1.00) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL5049300 0.93 IDO1 (0.93) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL11126478 0.93 IDO1 (0.93) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL10908172 0.93 IDO1 (0.93) IDO1CDC25BMAOAPIN1EHMT2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102449104-B Particle-toughened polymer compositions CYTEC TECH CORP 2015-01-21 CN claimed
CN-102449104-A Particle-toughened polymer compositions CYTEC TECH CORP 2012-05-09 CN claimed
WO-2010138556-A2 PARTICLE-TOUGHENED POLYMER COMPOSITIONS CYTEC TECHNOLOGY CORP. (US) 2010-12-02 WO claimed
EP-2794750-B1 MALEIMIDE RESINS CYTEC IND INC (US) 2020-12-09 EP disclosed
CN-109896947-B A kind of production method of 1,4-naphthoquinone, used catalyst and its application 上海谷雨医药科技有限公司 2019-07-30 CN disclosed
EP-3508523-A1 MALEIMIDE RESINS Cytec Industries Inc. (US) 2019-07-10 EP disclosed
CN-109896947-A A kind of production method of 1,4-naphthoquinone, used catalyst and its application 上海谷雨医药科技有限公司 2019-06-18 CN disclosed
US-9884942-B2 Maleimide resins CYTEC INDUSTRIES INC. (US) 2018-02-06 US disclosed
EP-2435529-B1 PARTICLE-TOUGHENED POLYMER COMPOSITIONS CYTEC TECH CORP (US) 2014-12-17 EP disclosed
EP-2794750-A1 MALEIMIDE RESINS Cytec Industries Inc. (US) 2014-10-29 EP disclosed
US-20140309352-A1 MALEIMIDE RESINS CYTEC INDUSTRIES INC. (US) 2014-10-16 US disclosed
CN-101120027-B Bismaleimide resin with high temperature thermal stability CYTEC TECH CORP 2011-09-28 CN disclosed
US-20100304119-A1 PARTICLE-TOUGHENED FIBER-REINFORCED POLYMER COMPOSITES CYTEC TECHNOLOGY CORP. (US) 2010-12-02 US disclosed
WO-2010138546-A1 PARTICLE-TOUGHENED FIBER-REINFORCED POLYMER COMPOSITES CYTEC TECHNOLOGY CORP. (US) 2010-12-02 WO disclosed
US-20100305274-A1 PARTICLE-TOUGHENED POLYMER COMPOSITIONS CYTEC TECHNOLOGY CORP. (US) 2010-12-02 US disclosed
WO-2010138556-A2 PARTICLE-TOUGHENED POLYMER COMPOSITIONS CYTEC TECHNOLOGY CORP. (US) 2010-12-02 WO disclosed
CN-101120027-A Bismaleimide resin with high temperature thermal stability CYTEC TECH CORP (US) 2008-02-06 CN disclosed
EP-1851258-A1 BISMALEIMIRE RESIN WITH HIGH TEMPERATURE THERMAL STABILITY CYTEC TECHNOLOGY CORP. (US) 2007-11-07 EP disclosed
US-20070117956-A1 Bismaleimide resin with high temperature thermal stability CYTEC TECHNOLOGY CORP. 2007-05-24 US disclosed
WO-2006088612-A1 BISMALEIMIRE RESIN WITH HIGH TEMPERATURE THERMAL STABILITY CYTEC TECHNOLOGY CORP. (US) 2006-08-24 WO disclosed