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BDBM35610 pyrazolo pyrimidine, 5p

SMILES: C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1)c1ccccc1

InChI Key: InChIKey=OYYLCADNQLXODI-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 35610   
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
p110α/p85α


(Homo sapiens (Human))
BDBM35610
PNG
(pyrazolo pyrimidine, 5p)
Show SMILES C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C29H31N7O/c1-2-4-21(5-3-1)20-34-12-9-24(10-13-34)36-29-25(19-31-36)28(35-14-16-37-17-15-35)32-27(33-29)23-6-7-26-22(18-23)8-11-30-26/h1-8,11,18-19,24,30H,9-10,12-17,20H2
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.01E+3n/an/an/an/an/a25



Wyeth Research



Assay Description
Inhibition of PI3K enzyme activity is measured in a microtiter plate-based fluorescence polarization (FP) assay.


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR


(Homo sapiens (Human))
BDBM35610
PNG
(pyrazolo pyrimidine, 5p)
Show SMILES C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C29H31N7O/c1-2-4-21(5-3-1)20-34-12-9-24(10-13-34)36-29-25(19-31-36)28(35-14-16-37-17-15-35)32-27(33-29)23-6-7-26-22(18-23)8-11-30-26/h1-8,11,18-19,24,30H,9-10,12-17,20H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 88n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair