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BDBM50205363 6-(benzylamino)purine::6-BAP::6-[(phenylmethyl)amino]-9H-purine::BAP::CHEMBL228862::Cytokinin B::N(6)-(benzylamino)purine::N-benzyl-9H-purin-6-amine::N-benzyladenine::benzyladenine

SMILES: C(Nc1ncnc2nc[nH]c12)c1ccccc1

InChI Key: InChIKey=NWBJYWHLCVSVIJ-UHFFFAOYSA-N

Data: 1 KI  2 IC50  1 Kd

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 = 50205363   
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
Phosphatidylinositol 4-kinase type 2-alpha


(Homo sapiens (Human))
BDBM50205363
PNG
(6-(benzylamino)purine | 6-BAP | 6-[(phenylmethyl)a...)
Show SMILES C(Nc1ncnc2nc[nH]c12)c1ccccc1
Show InChI InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)
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PubMed
1.99E+5n/an/an/an/an/an/an/an/a



Smith Kline& French Research Limited

Curated by ChEMBL


Assay Description
Binding affinity (Ki) against human phosphatidylinositol 4-kinase


J Med Chem 33: 2073-80 (1990)


BindingDB Entry DOI: 10.7270/Q25T3NQV
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-kinase type 2-alpha


(Homo sapiens (Human))
BDBM50205363
PNG
(6-(benzylamino)purine | 6-BAP | 6-[(phenylmethyl)a...)
Show SMILES C(Nc1ncnc2nc[nH]c12)c1ccccc1
Show InChI InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)
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PubMed
n/an/a 2.40E+5n/an/an/an/an/an/a



Smith Kline& French Research Limited

Curated by ChEMBL


Assay Description
Inhibitory activity (IC50) against human phosphatidylinositol 4-kinase at the ATP binding site


J Med Chem 33: 2073-80 (1990)


BindingDB Entry DOI: 10.7270/Q25T3NQV
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50205363
PNG
(6-(benzylamino)purine | 6-BAP | 6-[(phenylmethyl)a...)
Show SMILES C(Nc1ncnc2nc[nH]c12)c1ccccc1
Show InChI InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)
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Article
PubMed
n/an/a 2.00E+5n/an/an/an/an/an/a



Charles University

Curated by ChEMBL


Assay Description
Inhibitory activity against purified cdc2 p34/Cyclin B obtained from M phase oocytes of the starfish Marthasterias glacialis.


J Med Chem 40: 408-12 (1997)


Article DOI: 10.1021/jm960666x
BindingDB Entry DOI: 10.7270/Q2GF0SNG
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50205363
PNG
(6-(benzylamino)purine | 6-BAP | 6-[(phenylmethyl)a...)
Show SMILES C(Nc1ncnc2nc[nH]c12)c1ccccc1
Show InChI InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)
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n/an/an/a 2.47E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to ERK2 (unknown origin) by surface plasmon resonance assay


Bioorg Med Chem Lett 25: 4728-32 (2015)


BindingDB Entry DOI: 10.7270/Q2TB18QM
More data for this
Ligand-Target Pair