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BDBM50137570 CHEMBL291759::[4-(3-{2-[5-Methylsulfamoyl-2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-4,5,6,7-tetrahydro-1H-indol-3-yl}-propyl)-piperazin-1-yl]-acetic acid ethyl ester

SMILES: CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1

InChI Key: InChIKey=WJAKMUHDSIHSPY-MOHJPFBDSA-N

Data: 8 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 8 hits for monomerid = 50137570   
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
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50137570
PNG
(CHEMBL291759 | [4-(3-{2-[5-Methylsulfamoyl-2-oxo-1...)
Show SMILES CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
Show InChI InChI=1S/C29H39N5O5S/c1-3-39-28(35)19-34-15-13-33(14-16-34)12-6-8-22-21-7-4-5-9-25(21)31-27(22)18-24-23-17-20(40(37,38)30-2)10-11-26(23)32-29(24)36/h10-11,17-18,30-31H,3-9,12-16,19H2,1-2H3,(H,32,36)/b24-18-
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n/an/a 70n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Src protein tryrosine kinase

Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Fyn


(Homo sapiens (Human))		BDBM50137570
PNG
(CHEMBL291759 | [4-(3-{2-[5-Methylsulfamoyl-2-oxo-1...)
Show SMILES CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
Show InChI InChI=1S/C29H39N5O5S/c1-3-39-28(35)19-34-15-13-33(14-16-34)12-6-8-22-21-7-4-5-9-25(21)31-27(22)18-24-23-17-20(40(37,38)30-2)10-11-26(23)32-29(24)36/h10-11,17-18,30-31H,3-9,12-16,19H2,1-2H3,(H,32,36)/b24-18-
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n/an/a 500n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Fyn tyrosine kinase

Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))		BDBM50137570
PNG
(CHEMBL291759 | [4-(3-{2-[5-Methylsulfamoyl-2-oxo-1...)
Show SMILES CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
Show InChI InChI=1S/C29H39N5O5S/c1-3-39-28(35)19-34-15-13-33(14-16-34)12-6-8-22-21-7-4-5-9-25(21)31-27(22)18-24-23-17-20(40(37,38)30-2)10-11-26(23)32-29(24)36/h10-11,17-18,30-31H,3-9,12-16,19H2,1-2H3,(H,32,36)/b24-18-
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n/an/a 80n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Fibroblast growth factor receptor 1

Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50137570
PNG
(CHEMBL291759 | [4-(3-{2-[5-Methylsulfamoyl-2-oxo-1...)
Show SMILES CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
Show InChI InChI=1S/C29H39N5O5S/c1-3-39-28(35)19-34-15-13-33(14-16-34)12-6-8-22-21-7-4-5-9-25(21)31-27(22)18-24-23-17-20(40(37,38)30-2)10-11-26(23)32-29(24)36/h10-11,17-18,30-31H,3-9,12-16,19H2,1-2H3,(H,32,36)/b24-18-
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n/an/a 900n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against cellular Src protein tryrosine kinase using the actin ring assay

Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))		BDBM50137570
PNG
(CHEMBL291759 | [4-(3-{2-[5-Methylsulfamoyl-2-oxo-1...)
Show SMILES CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
Show InChI InChI=1S/C29H39N5O5S/c1-3-39-28(35)19-34-15-13-33(14-16-34)12-6-8-22-21-7-4-5-9-25(21)31-27(22)18-24-23-17-20(40(37,38)30-2)10-11-26(23)32-29(24)36/h10-11,17-18,30-31H,3-9,12-16,19H2,1-2H3,(H,32,36)/b24-18-
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n/an/a 600n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lck tyrosine kinase

Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50137570
PNG
(CHEMBL291759 | [4-(3-{2-[5-Methylsulfamoyl-2-oxo-1...)
Show SMILES CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
Show InChI InChI=1S/C29H39N5O5S/c1-3-39-28(35)19-34-15-13-33(14-16-34)12-6-8-22-21-7-4-5-9-25(21)31-27(22)18-24-23-17-20(40(37,38)30-2)10-11-26(23)32-29(24)36/h10-11,17-18,30-31H,3-9,12-16,19H2,1-2H3,(H,32,36)/b24-18-
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n/an/a 500n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Vascular endothelial growth factor receptor 2

Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50137570
PNG
(CHEMBL291759 | [4-(3-{2-[5-Methylsulfamoyl-2-oxo-1...)
Show SMILES CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
Show InChI InChI=1S/C29H39N5O5S/c1-3-39-28(35)19-34-15-13-33(14-16-34)12-6-8-22-21-7-4-5-9-25(21)31-27(22)18-24-23-17-20(40(37,38)30-2)10-11-26(23)32-29(24)36/h10-11,17-18,30-31H,3-9,12-16,19H2,1-2H3,(H,32,36)/b24-18-
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n/an/a>2.00E+4n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against PDGFRbeta tyrosine kinase

Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))		BDBM50137570
PNG
(CHEMBL291759 | [4-(3-{2-[5-Methylsulfamoyl-2-oxo-1...)
Show SMILES CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
Show InChI InChI=1S/C29H39N5O5S/c1-3-39-28(35)19-34-15-13-33(14-16-34)12-6-8-22-21-7-4-5-9-25(21)31-27(22)18-24-23-17-20(40(37,38)30-2)10-11-26(23)32-29(24)36/h10-11,17-18,30-31H,3-9,12-16,19H2,1-2H3,(H,32,36)/b24-18-
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n/an/a 20n/an/an/an/an/an/a



SUGEN, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Yes tyrosine kinase

Bioorg Med Chem Lett 14: 187-90 (2003)


BindingDB Entry DOI: 10.7270/Q2HM57VG
More data for this
Ligand-Target Pair