BDBM83974 (13aS)-3,10-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolin[2,1-b]isoquinoline-2,9-diol::(13aS)-3,10-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,9-diol::MLS002153900::SMR001233249::Scoulerine::cid_439654

SMILES COc1cc2CCN3Cc4c(C[C@H]3c2cc1O)ccc(OC)c4O

InChI Key InChIKey=KNWVMRVOBAFFMH-UHFFFAOYSA-N

Data  2 KI  7 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 83974   

TargetCaspase-9(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataIC50: 4.30E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/6/2012
Entry Details
PCBioAssay
TargetApoptotic protease-activating factor 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataIC50: 1.63E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay
TargetApoptotic protease-activating factor 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataIC50: 1.00E+5nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay
TargetTyrosyl-DNA phosphodiesterase 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataIC50: 1.28E+5nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/8/2014
Entry Details
PCBioAssay
TargetAcetylcholinesterase(Human)
Tianjin University of Technology

Curated by ChEMBL
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataIC50: 1.43E+5nMAssay Description:Inhibition of AChE (unknown origin) using ATCI as substrate preincubated for 15 min followed by substrate addition measured after 40 min by Ellman's ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/22/2024
Entry Details
PubMed
TargetCholinesterase(Human)
Tianjin University of Technology

Curated by ChEMBL
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataIC50: 6.13E+4nMAssay Description:Inhibition of BChE (unknown origin) using BTCI as substrate preincubated for 15 min followed by substrate addition measured after 40 min by Ellman's ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/22/2024
Entry Details
PubMed
TargetAmyloid-beta precursor protein(Human)
Tianjin University of Technology

Curated by ChEMBL
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of amyloid beta 42 (unknown origin) aggregation incubated for 24 hrs by ThT assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/22/2024
Entry Details
PubMed
TargetD(1A) dopamine receptor(Human)
Chinese Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataKi:  22nMAssay Description:Displacement of [3H]SCH23390 from dopamine D1 receptor (unknown origin) expressed in human HEK293 cells by liquid scintillation counterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Chinese Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM83974(SMR001233249 | MLS002153900 | (13aS)-3,10-dimethox...)
Affinity DataKi:  214nMAssay Description:Displacement of [3H]spiperone from dopamine D2 receptor (unknown origin) expressed in human HEK293 cells by liquid scintillation counterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed