Acifluorfen

Acifluorfen

SCHEMBL8936622

O=C(O)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-].O=C([O-])c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-].[Na+]

nearest known ligand 0.90

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 Acifluorfen. 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
TDP1 Q9NUW8 3/20 0.90
MEN1 O00255 1/20 0.90
TTR P02766 1/20 0.90
PPOX P50336 1/20 0.90
KMT2A Q03164 1/20 0.90
FFAR1 O14842 5/20 0.48
PYGL P06737 1/20 0.47
MRGPRX4 Q96LA9 6/20 0.46
AKR1B1 P15121 1/20 0.46
AKR1C4 P17516 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
AKR1C1 Q04828 1/20 0.46
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.43
CCR6 P51684 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
HPGD P15428 1/20 0.42

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
Acifluorfen SCHEMBL39453 0.96 TDP1 (0.82) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL30370086 0.96 TDP1 (0.82) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL29352750 0.96 TDP1 (0.82) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL3690938 0.96 TDP1 (0.98) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL29471425 0.96 TDP1 (0.82) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL3228873 0.95 TDP1 (1.00) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL29448829 0.95 TDP1 (1.00) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL8028079 0.95 TDP1 (1.00) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL38929 0.95 TDP1 (1.00) TDP1MEN1TTRPPOXKMT2A
Acifluorfen SCHEMBL29445767 0.95 TDP1 (1.00) TDP1MEN1TTRPPOXKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5562914-A FOR CONTROLLED RELEASE OF ACTIVE MATERIAL THROUGH POLYURETHANE MATRIX ZENECA INC. (US) 1996-10-08 US disclosed
US-5563112-A Herbicidal diphenyl ether and nitrogen solution compositions and method ZENECA LIMITED (GB) 1996-10-08 US disclosed
US-5173105-A Herbicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-22 US disclosed
US-5152826-A Herbicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-10-06 US disclosed
US-5076832-A Certain 3-(substituted phenyl)-5-(substituted phenyl)-1-ethylimidazolidine-4-ones as herbicides ICI AMERICAS INC. (US) 1991-12-31 US disclosed
US-4957538-A HERBICIDES ICI AMERICAS INC. (US) 1990-09-18 US disclosed
US-4869748-A HERBICIDES ICI AMERICAS INC. (US) 1989-09-26 US disclosed