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Dimethylamine

Dimethylamine

SCHEMBL5821096

CNC.N#Cc1c(C(F)(F)F)cc(-c2cccc(-c3ccc(C(=O)O)cc3)c2)n(Cc2ccc(F)cc2F)c1=O

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 3/20 0.63
▸ NR1H2 P55055 3/20 0.63
▸ NR1H3 Q13133 3/20 0.63
▸ KCNK3 O14649 6/20 0.38
▸ PPARG P37231 1/20 0.38
▸ GRIA2 P42262 1/20 0.37
▸ GRIA4 P48058 1/20 0.37
▸ MCHR1 Q99705 6/20 0.37
▸ EPHX2 P34913 1/20 0.37
▸ TNKS O95271 1/20 0.35
▸ TNKS2 Q9H2K2 1/20 0.35
▸ PTGER1 P34995 1/20 0.35

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
SCHEMBL2391037 0.92 RXRA (0.61) RXRANR1H2NR1H3KCNK3PPARG
SCHEMBL2392062 0.91 RXRA (0.63) RXRANR1H2NR1H3KCNK3PPARG
SCHEMBL2389509 0.89 RXRA (0.63) RXRANR1H2NR1H3KCNK3MCHR1
SCHEMBL14214340 0.89 RXRA (0.75) RXRANR1H2NR1H3KCNK3
SCHEMBL2389383 0.89 RXRA (0.61) RXRANR1H2NR1H3KCNK3MCHR1
SCHEMBL2387766 0.88 RXRA (0.62) RXRANR1H2NR1H3KCNK3PPARG
SCHEMBL2385115 0.87 RXRA (0.61) RXRANR1H2NR1H3PPARGEPHX2
SCHEMBL2389385 0.87 RXRA (0.65) RXRANR1H2NR1H3KCNK3PPARG
SCHEMBL2387401 0.86 RXRA (0.62) RXRANR1H2NR1H3KCNK3TNKS
SCHEMBL5821097 0.86 RXRA (0.60) RXRANR1H2NR1H3KCNK3MCHR1

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
WO-2006025979-A9 MODULATORS OF NUCLEAR RECEPTORS EXELIXIS INC (US) 2006-04-20 — — WO claimed