Fluroxypyr

Fluroxypyr

SCHEMBL28706288

COC(=O)NS(=O)(=O)c1ccc(NC(=O)COc2ccc(Cl)cc2C)cc1.Nc1c(Cl)c(F)nc(OCC(=O)O)c1Cl

nearest known ligand 0.56

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CETP P11597 1/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
NPC1 O15118 1/20 0.42
HTT P42858 1/20 0.42
TSHR P16473 2/20 0.41
GAA P10253 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
SCHEMBL134430 0.83 MEN1 (0.58) POLBMEN1KMT2AMAPTKDM4E
SCHEMBL4897413 0.83 MEN1 (0.58) POLBMEN1KMT2AMAPTKDM4E
SCHEMBL21225837 0.80 KMT2A (0.54) POLBMEN1KMT2AMAPTKDM4E
SCHEMBL14809963 0.77 POLB (0.51) POLBMEN1KMT2AMAPTKDM4E
SCHEMBL20601872 0.76 POLB (0.54) POLBMEN1KMT2AMAPTKDM4E
Fluroxypyr SCHEMBL21173647 0.73 TDP1 (0.61) MEN1KMT2AMAPTTSHR
SCHEMBL28921743 0.73 MEN1 (0.50) POLBMEN1KMT2AMAPTKDM4E
Fluroxypyr SCHEMBL30612286 0.69 TDP1 (0.34) KMT2AKDM4EHPGDHSD17B10NPSR1
SCHEMBL10165416 0.68 GAA (0.51) POLBMEN1KMT2AMAPTHPGD
SCHEMBL10857636 0.68 NOTUM (0.70) MEN1KMT2AMAPTNPSR1NPC1

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-110997757-B Isocyanate-functional silicone-polyether copolymers, silicone-polyether-urethane copolymers formed therewith, sealants including the same, and related methods 美国陶氏有机硅公司 2022-03-08 CN disclosed