Dimethylamine

Dimethylamine

SCHEMBL6624345

CNC.COc1cc2c(cc1OC)N(C)C(=O)CN=C2C=Cc1ccccc1.COc1cc2c(cc1OC)N(C)C(=O)CN=C2c1ccccc1

nearest known ligand 0.54

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.54
GABRA1 P14867 6/20 0.49
GABRG2 P18507 6/20 0.49
GABRB3 P28472 6/20 0.49
GABRA5 P31644 6/20 0.49
GABRA3 P34903 6/20 0.49
GABRA2 P47869 6/20 0.49
GABRB2 P47870 4/20 0.49
GABRP O00591 1/20 0.49
GABRD O14764 1/20 0.49
CACNA1F O60840 1/20 0.49
ALB P02768 1/20 0.49
GABRB1 P18505 1/20 0.49
OPRK1 P41145 1/20 0.49
AKR1C3 P42330 1/20 0.49
GABRA4 P48169 1/20 0.49
AKR1C2 P52895 1/20 0.49
GABRE P78334 1/20 0.49
CACNA1D Q01668 1/20 0.49
AKR1C1 Q04828 1/20 0.49

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
SCHEMBL5493708 0.90 PDE2A (0.46) PDE2AGABRA1GABRG2GABRB3GABRA5
SCHEMBL5493713 0.90 PDE2A (0.46) PDE2AGABRA1GABRG2GABRB3GABRA5
Dimethylamine SCHEMBL5493029 0.89 PDE2A (0.65) PDE2AGABRA1GABRG2GABRB3GABRA5
SCHEMBL5360424 0.86 PDE2A (0.66) PDE2AGABRA1GABRG2GABRB3GABRA5
SCHEMBL5496998 0.82 PDE2A (0.67) PDE2AGABRA1GABRG2GABRB3GABRA5
SCHEMBL4709638 0.81 PDE2A (0.58) PDE2AGABRA1GABRG2GABRB3GABRA5
SCHEMBL5489020 0.79 PDE2A (0.58) PDE2AGABRA1GABRG2GABRB3GABRA5
SCHEMBL5489176 0.78 PDE2A (0.66) PDE2AGABRA1GABRG2GABRB3GABRA5
SCHEMBL4709075 0.78 PDE2A (0.61) PDE2AGABRA1GABRG2GABRB3GABRA5
SCHEMBL5488783 0.77 PDE2A (0.68) PDE2AGABRA1GABRG2GABRB3GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392663-A2 CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF NEURO3D (FR) 2004-03-03 EP claimed
WO-2002098865-A2 CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF NEURO3D (FR) 2002-12-12 WO claimed