Acacetin

Acacetin

SCHEMBL8309340

CC=CO.COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 6/20 0.86
MAPT P10636 6/20 0.86
CYP1A1 P04798 5/20 0.86
CYP1A2 P05177 5/20 0.86
MEN1 O00255 5/20 0.86
KMT2A Q03164 5/20 0.86
MAOB P27338 4/20 0.86
IP6K2 Q9UHH9 4/20 0.86
FLT3 P36888 4/20 0.86
NPC1 O15118 4/20 0.86
CYP3A4 P08684 4/20 0.86
CYP2C9 P11712 4/20 0.86
CYP2C19 P33261 4/20 0.86
ALDH1A1 P00352 4/20 0.86
MAOA P21397 4/20 0.86
TP53 P04637 3/20 0.86
CYP2D6 P10635 3/20 0.86
MAPK1 P28482 3/20 0.86
SMN1; SMN2 Q16637 3/20 0.86
HIF1A Q16665 3/20 0.86

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
Acacetin SCHEMBL29387049 0.93 CYP1B1 (1.00) CYP1B1MAPTCYP1A1CYP1A2MEN1
Acacetin SCHEMBL107712 0.93 CYP1B1 (1.00) CYP1B1MAPTCYP1A1CYP1A2MEN1
Acacetin SCHEMBL28278297 0.92 CYP1B1 (0.97) CYP1B1MAPTCYP1A1CYP1A2MEN1
Apigenin Dimethylether SCHEMBL1176691 0.88 MAOB (1.00) CYP1B1MAPTCYP1A1CYP1A2MEN1
Apigenin Dimethylether SCHEMBL29392759 0.88 MAOB (1.00) CYP1B1MAPTCYP1A1CYP1A2MEN1
SCHEMBL8429597 0.86 XDH (0.70) CYP1B1MAPTCYP1A1CYP1A2MEN1
SCHEMBL8308052 0.86 MAOB (0.67) CYP1B1MAPTCYP1A1CYP1A2MEN1
Acacetin SCHEMBL8304770 0.86 CYP1B1 (0.86) CYP1B1MAPTCYP1A1CYP1A2MEN1
SCHEMBL8305040 0.85 MAPT (0.73) CYP1B1MAPTCYP1A1CYP1A2MEN1
SCHEMBL8429204 0.83 MAOB (0.62) CYP1B1MAPTCYP1A1CYP1A2MEN1

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-0709383-B1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-12-15 EP disclosed
EP-0709383-A1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-05-01 EP disclosed