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BDBM316207 N-(3-((dimethylamino)methyl)-4-methoxyphenyl)-6-(2-methoxyphenyl)pyrimidin-4-amine::US10294218, Example 35::US9617225, Example 35

SMILES: COc1ccc(Nc2cc(ncn2)-c2ccccc2OC)cc1CN(C)C

InChI Key: InChIKey=MQMKWVXZZLZFSN-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 316207   
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))
BDBM316207
PNG
(N-(3-((dimethylamino)methyl)-4-methoxyphenyl)-6-(2...)
Show SMILES COc1ccc(Nc2cc(ncn2)-c2ccccc2OC)cc1CN(C)C
Show InChI InChI=1S/C21H24N4O2/c1-25(2)13-15-11-16(9-10-19(15)26-3)24-21-12-18(22-14-23-21)17-7-5-6-8-20(17)27-4/h5-12,14H,13H2,1-4H3,(H,22,23,24)
PDB
MMDB

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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))
BDBM316207
PNG
(N-(3-((dimethylamino)methyl)-4-methoxyphenyl)-6-(2...)
Show SMILES COc1ccc(Nc2cc(ncn2)-c2ccccc2OC)cc1CN(C)C
Show InChI InChI=1S/C21H24N4O2/c1-25(2)13-15-11-16(9-10-19(15)26-3)24-21-12-18(22-14-23-21)17-7-5-6-8-20(17)27-4/h5-12,14H,13H2,1-4H3,(H,22,23,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
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antibodypedia
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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