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BDBM49194 1-phenyl-N-(2-phenylethyl)-4-pyrazolo[3,4-d]pyrimidinamine::1-phenyl-N-(2-phenylethyl)pyrazolo[3,4-d]pyrimidin-4-amine::MLS000037893::SMR000016985::cid_611207::phenethyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amine

SMILES: C(Cc1ccccc1)Nc1ncnc2n(ncc12)-c1ccccc1

InChI Key: InChIKey=WATVEGJMUSVOKA-UHFFFAOYSA-N

Data: 3 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 49194   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Nuclear factor NF-kappa-B


(Homo sapiens (Human))
BDBM49194
PNG
(1-phenyl-N-(2-phenylethyl)-4-pyrazolo[3,4-d]pyrimi...)
Show SMILES C(Cc1ccccc1)Nc1ncnc2n(ncc12)-c1ccccc1
Show InChI InChI=1S/C19H17N5/c1-3-7-15(8-4-1)11-12-20-18-17-13-23-24(19(17)22-14-21-18)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2,(H,20,21,22)
PDB

KEGG

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PC sid
UniChem

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PCBioAssay
n/an/an/an/a 2.74E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Caspase-3


(Homo sapiens (Human))
BDBM49194
PNG
(1-phenyl-N-(2-phenylethyl)-4-pyrazolo[3,4-d]pyrimi...)
Show SMILES C(Cc1ccccc1)Nc1ncnc2n(ncc12)-c1ccccc1
Show InChI InChI=1S/C19H17N5/c1-3-7-15(8-4-1)11-12-20-18-17-13-23-24(19(17)22-14-21-18)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2,(H,20,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
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n/an/a 2.25E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2RJ4GZT
More data for this
Ligand-Target Pair
SUMO-1-specific protease


(Homo sapiens (Human))
BDBM49194
PNG
(1-phenyl-N-(2-phenylethyl)-4-pyrazolo[3,4-d]pyrimi...)
Show SMILES C(Cc1ccccc1)Nc1ncnc2n(ncc12)-c1ccccc1
Show InChI InChI=1S/C19H17N5/c1-3-7-15(8-4-1)11-12-20-18-17-13-23-24(19(17)22-14-21-18)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2,(H,20,21,22)
KEGG

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n/an/a 1.96E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q27H1H10
More data for this
Ligand-Target Pair
SUMO/sentrin specific peptidase family member 8


(Homo sapiens (Human))
BDBM49194
PNG
(1-phenyl-N-(2-phenylethyl)-4-pyrazolo[3,4-d]pyrimi...)
Show SMILES C(Cc1ccccc1)Nc1ncnc2n(ncc12)-c1ccccc1
Show InChI InChI=1S/C19H17N5/c1-3-7-15(8-4-1)11-12-20-18-17-13-23-24(19(17)22-14-21-18)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2,(H,20,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.29E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MS3R7H
More data for this
Ligand-Target Pair