BDBM83957 3-(2,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide::3-(2,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide::3-(2,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide::3-(2,4-dimethoxyphenyl)-N-[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide::MLS000936200::SMR000620917::cid_6619046

SMILES COc1ccc(c(OC)c1)-n1nc(C(=O)NCC(=O)NC2CCCC(C)C2C)c2ccccc2c1=O

InChI Key InChIKey=ZYSCSSCVRVBIIR-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 83957   

TargetCaspase-9(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83957BDBM83957(cid_6619046 | 3-(2,4-dimethoxyphenyl)-N-[2-[(2,3-d...)
Affinity DataIC50: 6.64E+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
LigandChemical structure of BindingDB Monomer ID 83957BDBM83957(cid_6619046 | 3-(2,4-dimethoxyphenyl)-N-[2-[(2,3-d...)
Affinity DataIC50: 1.45E+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
LigandChemical structure of BindingDB Monomer ID 83957BDBM83957(cid_6619046 | 3-(2,4-dimethoxyphenyl)-N-[2-[(2,3-d...)
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