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BDBM316211 N-(3-((1H-benzo[d]imidazol-1-yl)methyl)-4-ethoxyphenyl)-6-(2-methoxyphenyl)pyrimidin-4-amine::US10294218, Example 39::US9617225, Example 39

SMILES: CCOc1ccc(Nc2cc(ncn2)-c2ccccc2OC)cc1Cn1cnc2ccccc12

InChI Key: InChIKey=JWXKFKUHLAQGQX-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 = 316211   
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
Cyclin-Dependent Kinase 9 (CDK9)


(Homo sapiens (Human))
BDBM316211
PNG
(N-(3-((1H-benzo[d]imidazol-1-yl)methyl)-4-ethoxyph...)
Show SMILES CCOc1ccc(Nc2cc(ncn2)-c2ccccc2OC)cc1Cn1cnc2ccccc12
Show InChI InChI=1S/C27H25N5O2/c1-3-34-25-13-12-20(14-19(25)16-32-18-30-22-9-5-6-10-24(22)32)31-27-15-23(28-17-29-27)21-8-4-7-11-26(21)33-2/h4-15,17-18H,3,16H2,1-2H3,(H,28,29,31)
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PC sid
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US Patent
n/an/a<100n/an/an/an/an/an/a



GSK



Assay Description
The activity of the compounds described in the present invention can be determined by measuring the phosphorylation of a fluorescently-labeled peptid...


Bioorg Med Chem Lett 18: 1022-6 (2008)


BindingDB Entry DOI: 10.7270/Q2RB76X4
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 9


(Homo sapiens (Human))
BDBM316211
PNG
(N-(3-((1H-benzo[d]imidazol-1-yl)methyl)-4-ethoxyph...)
Show SMILES CCOc1ccc(Nc2cc(ncn2)-c2ccccc2OC)cc1Cn1cnc2ccccc12
Show InChI InChI=1S/C27H25N5O2/c1-3-34-25-13-12-20(14-19(25)16-32-18-30-22-9-5-6-10-24(22)32)31-27-15-23(28-17-29-27)21-8-4-7-11-26(21)33-2/h4-15,17-18H,3,16H2,1-2H3,(H,28,29,31)
PDB
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PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



VIROSTATICS SRL

US Patent


Assay Description
The activity of the compounds described in the present invention can be determined by measuring the phosphorylation of a fluorescently-labeled peptid...


US Patent US9617225 (2017)


BindingDB Entry DOI: 10.7270/Q29W0HK6
More data for this
Ligand-Target Pair