Atrazine

Atrazine

SCHEMBL9876366

CCCC(=O)Oc1c(Br)cc(C#N)cc1Br.CCNc1nc(Cl)nc(NC(C)C)n1.CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 2/20 0.36
ALDH1A1 P00352 5/20 0.36
KMT2A Q03164 4/20 0.35
TSHR P16473 3/20 0.35
NPSR1 Q6W5P4 3/20 0.35
HTT P42858 2/20 0.35
TP53 P04637 2/20 0.35
MAPK1 P28482 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CREBBP Q92793 1/20 0.34
LMNA P02545 2/20 0.33
MEN1 O00255 2/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.31
PKM P14618 1/20 0.31

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
Dcmu SCHEMBL9876837 0.95 APEX1 (0.42) APEX1L3MBTL1MAPTALDH1A1KMT2A
Atrazine SCHEMBL9876705 0.93 MAPT (0.33) APEX1L3MBTL1MAPTALDH1A1KMT2A
Atrazine SCHEMBL9876273 0.87 ALDH1A1 (0.43) L3MBTL1MAPTALDH1A1KMT2ATSHR
Dcmu SCHEMBL9876450 0.87 APEX1 (0.35) APEX1MAPTALDH1A1KMT2ALMNA
Atrazine SCHEMBL9983133 0.82 APEX1 (0.56) APEX1L3MBTL1MAPTKMT2ATSHR
Simazine SCHEMBL9876438 0.81 LMNA (0.40) MAPTALDH1A1KMT2AHTTKDM4E
Atrazine SCHEMBL9876340 0.79 ALDH1A1 (0.39) L3MBTL1MAPTALDH1A1KMT2ATSHR
Dcmu SCHEMBL9876296 0.78 APEX1 (0.41) APEX1L3MBTL1MAPTALDH1A1KMT2A
Dcmu SCHEMBL8736974 0.76 APEX1 (0.66) APEX1MAPTALDH1A1KMT2ATSHR
Simazine SCHEMBL9876727 0.73 LMNA (0.32) HTTKDM4ELMNAPKM

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-5021083-A Stable aqueous or aqueous alcoholic dispersion based on derivatives of oxynil, herbicidal composition comprised thereof and selective herbicidal treatment comprising the use of the said herbicidal composition COMPAGNIE FRANCAISE DE PRODUITS INDUSTRIELS (FR) 1991-06-04 US disclosed