BDBM83992 (2R)-2-[[7-(benzylamino)-3-isopropyl-benzimidazol-5-yl]amino]propan-1-ol::(2R)-2-[[7-(benzylamino)-3-propan-2-ylbenzimidazol-5-yl]amino]propan-1-ol::(2R)-2-[[7-[(phenylmethyl)amino]-3-propan-2-yl-5-benzimidazolyl]amino]-1-propanol::(2R)-2-[[7-[(phenylmethyl)amino]-3-propan-2-yl-benzimidazol-5-yl]amino]propan-1-ol::MLS002471441::SMR001395107::cid_44143082

SMILES C[C@H](CO)Nc1cc(NCc2ccccc2)c2ncn(C(C)C)c2c1

InChI Key InChIKey=UUJSPQQNHYVWIF-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 83992   

TargetCaspase-9(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83992(MLS002471441 | (2R)-2-[[7-[(phenylmethyl)amino]-3-...)
Affinity DataIC50: 2.22E+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
LigandPNGBDBM83992(MLS002471441 | (2R)-2-[[7-[(phenylmethyl)amino]-3-...)
Affinity DataIC50: 1.22E+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:
1/5/2012
Entry Details
PCBioAssay
TargetApoptotic protease-activating factor 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83992(MLS002471441 | (2R)-2-[[7-[(phenylmethyl)amino]-3-...)
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