Sanguinarium

Sanguinarium

SCHEMBL9698540

CC(O)C(=O)[O-].C[n+]1cc2c3c(ccc2c2ccc4cc5c(cc4c21)OCO5)OCO3

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM1DRD2DRD3DRD4HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR2APDE3ASIGMAR1SLC9A3

The experimentally established mechanism targets of Sanguinarium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAD Q92934 7/20 0.77
ALDH1A1 P00352 6/20 0.77
MAPT P10636 6/20 0.77
HPGD P15428 6/20 0.77
SMN1; SMN2 Q16637 6/20 0.77
MAPK1 P28482 5/20 0.77
KMT2A Q03164 5/20 0.77
KDM4E B2RXH2 4/20 0.77
MEN1 O00255 4/20 0.77
LMNA P02545 4/20 0.77
ACHE P22303 4/20 0.77
TP53 P04637 3/20 0.77
CYP3A4 P08684 3/20 0.77
ALOX15 P16050 3/20 0.77
ALOX12 P18054 3/20 0.77
HSD17B10 Q99714 3/20 0.77
BCHE P06276 3/20 0.77
RGS12 O14924 2/20 0.77
RGS17 Q9UGC6 2/20 0.77
NPC1 O15118 2/20 0.77

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
Sanguinarium SCHEMBL9405581 0.91 BAD (0.84) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL30153784 0.88 BAD (1.00) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL30129850 0.88 BAD (1.00) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL29385229 0.88 BAD (1.00) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL123241 0.88 BAD (1.00) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL23524622 0.88 BAD (1.00) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL454298 0.87 ALDH1A1 (0.91) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL43290 0.87 RAC1 (1.00) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL30668087 0.87 RAC1 (1.00) BADALDH1A1MAPTHPGDSMN1; SMN2
Sanguinarium SCHEMBL8584009 0.87 BAD (0.97) BADALDH1A1MAPTHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992000104-A1 MUCOSAL DELIVERY SYSTEMS FOR TREATMENT OF PERIODONTAL DISEASE ATRIX LABORATORIES, INC. (US) 1992-01-09 WO claimed
US-4975271-A Muscosal delivery systems for treatment of periodontal disease VIPONT PHARMACEUTICAL, INC. (US) 1990-12-04 US claimed
WO-1992000104-A1 MUCOSAL DELIVERY SYSTEMS FOR TREATMENT OF PERIODONTAL DISEASE ATRIX LABORATORIES, INC. (US) 1992-01-09 WO disclosed
US-4975271-A Muscosal delivery systems for treatment of periodontal disease VIPONT PHARMACEUTICAL, INC. (US) 1990-12-04 US disclosed