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BDBM142621 US8933228, 12

SMILES: COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C(C)C)c23)c2ccccc12)C(C)(C)C

InChI Key: InChIKey=URQAXVPGUSETSW-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 142621   
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
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM142621
PNG
(US8933228, 12)
Show SMILES COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C(C)C)c23)c2ccccc12)C(C)(C)C
Show InChI InChI=1S/C34H35N7O4/c1-20(2)40-30-27(17-18-35-31(30)38-33(40)43)45-26-16-15-25(23-9-7-8-10-24(23)26)36-32(42)37-29-19-28(34(3,4)5)39-41(29)21-11-13-22(44-6)14-12-21/h7-20H,1-6H3,(H,35,38,43)(H2,36,37,42)
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US Patent
n/an/a 11n/an/an/an/an/an/a



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Assay Description
The enzyme inhibitory activity of test compounds was determined by fluorescence resonance energy transfer (FRET) using synthetic peptides labelled wi...


US Patent US8933228 (2015)


BindingDB Entry DOI: 10.7270/Q2RV0MDW
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM142621
PNG
(US8933228, 12)
Show SMILES COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C(C)C)c23)c2ccccc12)C(C)(C)C
Show InChI InChI=1S/C34H35N7O4/c1-20(2)40-30-27(17-18-35-31(30)38-33(40)43)45-26-16-15-25(23-9-7-8-10-24(23)26)36-32(42)37-29-19-28(34(3,4)5)39-41(29)21-11-13-22(44-6)14-12-21/h7-20H,1-6H3,(H,35,38,43)(H2,36,37,42)
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US Patent
n/an/a 12n/an/an/an/an/an/a



Respivert Ltd

US Patent


Assay Description
The enzyme inhibitory activity of test compounds was determined by fluorescence resonance energy transfer (FRET) using synthetic peptides labelled wi...


US Patent US8933228 (2015)


BindingDB Entry DOI: 10.7270/Q2RV0MDW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase HCK


(Homo sapiens (Human))
BDBM142621
PNG
(US8933228, 12)
Show SMILES COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C(C)C)c23)c2ccccc12)C(C)(C)C
Show InChI InChI=1S/C34H35N7O4/c1-20(2)40-30-27(17-18-35-31(30)38-33(40)43)45-26-16-15-25(23-9-7-8-10-24(23)26)36-32(42)37-29-19-28(34(3,4)5)39-41(29)21-11-13-22(44-6)14-12-21/h7-20H,1-6H3,(H,35,38,43)(H2,36,37,42)
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US Patent
n/an/a 8n/an/an/an/an/an/a



Respivert Ltd

US Patent


Assay Description
The enzyme inhibitory activity of test compounds was determined by fluorescence resonance energy transfer (FRET) using synthetic peptides labelled wi...


US Patent US8933228 (2015)


BindingDB Entry DOI: 10.7270/Q2RV0MDW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 12


(Homo sapiens (Human))
BDBM142621
PNG
(US8933228, 12)
Show SMILES COc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C(C)C)c23)c2ccccc12)C(C)(C)C
Show InChI InChI=1S/C34H35N7O4/c1-20(2)40-30-27(17-18-35-31(30)38-33(40)43)45-26-16-15-25(23-9-7-8-10-24(23)26)36-32(42)37-29-19-28(34(3,4)5)39-41(29)21-11-13-22(44-6)14-12-21/h7-20H,1-6H3,(H,35,38,43)(H2,36,37,42)
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US Patent
n/an/a 495n/an/an/an/an/an/a



Respivert Ltd

US Patent


Assay Description
The enzyme inhibitory activity of test compounds was determined by fluorescence resonance energy transfer (FRET) using synthetic peptides labelled wi...


US Patent US8933228 (2015)


BindingDB Entry DOI: 10.7270/Q2RV0MDW
More data for this
Ligand-Target Pair