Chlorpyrifos

Chlorpyrifos

SCHEMBL9300722

CCOP(=S)(OCC)Oc1nc(Cl)c(Cl)cc1Cl.COP(=S)(OC)Oc1ccc(SC)c(C)c1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.61
CYP3A4 P08684 6/20 0.61
TSHR P16473 5/20 0.61
TDP1 Q9NUW8 5/20 0.61
HSD17B10 Q99714 4/20 0.61
MAPT P10636 4/20 0.61
MAPK1 P28482 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
ALOX15 P16050 1/20 0.61
ALOX12 P18054 1/20 0.61
ATM Q13315 1/20 0.61
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
HPGD P15428 2/20 0.43
KDM4E B2RXH2 3/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39

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
Fenthion SCHEMBL1933208 0.85 ALDH1A1 (0.81) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Chlorpyrifos-Methyl SCHEMBL16446205 0.83 TDP1 (0.62) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Chlorpyrifos SCHEMBL1069405 0.83 ALDH1A1 (0.89) ALDH1A1CYP3A4TSHRTDP1HSD17B10
SCHEMBL120468 0.80 ALDH1A1 (0.70) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Chlorpyrifos SCHEMBL21680 0.78 ALDH1A1 (1.00) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Chlorpyrifos SCHEMBL7908295 0.78 ALDH1A1 (1.00) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Chlorpyrifos SCHEMBL29011072 0.77 ALDH1A1 (0.97) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Chlorpyrifos SCHEMBL28566223 0.77 ALDH1A1 (0.97) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Chlorpyrifos SCHEMBL18228939 0.77 ALDH1A1 (0.97) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Chlorpyrifos SCHEMBL28945660 0.77 ALDH1A1 (0.97) ALDH1A1CYP3A4TSHRTDP1HSD17B10

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
US-5364627-A Active particles dispersed throughout wall; drug delivery; sustained release when contacted with solvent WM. WRIGLEY JR. COMPANY (US) 1994-11-15 US disclosed