Acetosulfone

Acetosulfone

SCHEMBL3672045

CC(=O)Nc1ccc(S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1.CC(=O)[N-]S(=O)(=O)c1cc(N)ccc1S(=O)(=O)c1ccc(N)cc1.[Na+]

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetosulfone. 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
CA1 known ✓ P00915 4/20 0.44
CA2 known ✓ P00918 4/20 0.44
CA12 known ✓ O43570 3/20 0.44
PKM P14618 2/20 0.64
CYP2C19 P33261 1/20 0.64
NPC1 O15118 1/20 0.48
GAA P10253 2/20 0.47
PRMT1 Q99873 3/20 0.46
KMT2A Q03164 2/20 0.44
CA9 Q16790 3/20 0.44
SETD7 Q8WTS6 1/20 0.43
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
PAX8 Q06710 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40

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
Acetosulfone SCHEMBL154571 0.89 PKM (0.43) PKMCYP2C19NPC1PRMT1KMT2A
Acetosulfone SCHEMBL30205068 0.89 PKM (0.43) PKMCYP2C19NPC1PRMT1KMT2A
Mono-N-Acetyl Dapsone SCHEMBL10920445 0.80 PKM (1.00) PKMCYP2C19NPC1GAAPRMT1
SCHEMBL9713853 0.79 PKM (0.67) PKMCYP2C19NPC1GAAPRMT1
SCHEMBL17779214 0.79 PKM (0.70) PKMCYP2C19NPC1GAAPRMT1
SCHEMBL9713935 0.77 PKM (0.67) PKMCYP2C19NPC1GAAPRMT1
SCHEMBL9713818 0.75 PKM (0.63) PKMCYP2C19NPC1GAAPRMT1
SCHEMBL9713813 0.74 CDK1 (0.67) PKMCYP2C19NPC1GAAKMT2A
SCHEMBL9713865 0.74 PKM (0.62) PKMCYP2C19NPC1GAAKMT2A
Acetosulfone SCHEMBL10697113 0.72 TSHR (0.64) PKMCYP2C19NPC1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7807803-B2 Nucleic acid compositions for stimulating immune responses COLEY PHARMACEUTICAL GROUP, INC. (US) 2010-10-05 US disclosed
US-7576066-B2 Nucleic acid compositions for stimulating immune responses COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-08-18 US disclosed
US-20040152649-A1 Nucleic acid compositions for stimulating immune responses COLEY PHARMACEUTICAL GROUP, INC. 2004-08-05 US disclosed
US-20040092472-A1 Nucleic acid compositions for stimulating immune responses COLEY PHARMACEUTICAL GROUP, INC. (US) 2004-05-13 US disclosed