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BDBM50137571 3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydro-1H-indol-2-yl]-meth-(Z)-ylidene]-2-oxo-2,3-dihydro-1H-indole-5-sulfonic acid methylamide::CHEMBL52513

SMILES: CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1

InChI Key: InChIKey=KNRLVDRDQDJIMP-RGEXLXHISA-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 = 50137571   
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
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50137571
PNG
(3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydr...)
Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N4O3S/c1-24-31(29,30)15-10-11-21-18(13-15)19(23(28)26-21)14-22-17(8-6-12-27(2)3)16-7-4-5-9-20(16)25-22/h10-11,13-14,24-25H,4-9,12H2,1-3H3,(H,26,28)/b19-14-
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n/an/a 1.60E+3n/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))
BDBM50137571
PNG
(3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydr...)
Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N4O3S/c1-24-31(29,30)15-10-11-21-18(13-15)19(23(28)26-21)14-22-17(8-6-12-27(2)3)16-7-4-5-9-20(16)25-22/h10-11,13-14,24-25H,4-9,12H2,1-3H3,(H,26,28)/b19-14-
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n/an/a 1.10E+3n/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
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50137571
PNG
(3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydr...)
Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N4O3S/c1-24-31(29,30)15-10-11-21-18(13-15)19(23(28)26-21)14-22-17(8-6-12-27(2)3)16-7-4-5-9-20(16)25-22/h10-11,13-14,24-25H,4-9,12H2,1-3H3,(H,26,28)/b19-14-
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n/an/a 700n/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))
BDBM50137571
PNG
(3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydr...)
Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N4O3S/c1-24-31(29,30)15-10-11-21-18(13-15)19(23(28)26-21)14-22-17(8-6-12-27(2)3)16-7-4-5-9-20(16)25-22/h10-11,13-14,24-25H,4-9,12H2,1-3H3,(H,26,28)/b19-14-
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n/an/a 100n/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 Fyn


(Homo sapiens (Human))
BDBM50137571
PNG
(3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydr...)
Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N4O3S/c1-24-31(29,30)15-10-11-21-18(13-15)19(23(28)26-21)14-22-17(8-6-12-27(2)3)16-7-4-5-9-20(16)25-22/h10-11,13-14,24-25H,4-9,12H2,1-3H3,(H,26,28)/b19-14-
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n/an/a 60n/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
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50137571
PNG
(3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydr...)
Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N4O3S/c1-24-31(29,30)15-10-11-21-18(13-15)19(23(28)26-21)14-22-17(8-6-12-27(2)3)16-7-4-5-9-20(16)25-22/h10-11,13-14,24-25H,4-9,12H2,1-3H3,(H,26,28)/b19-14-
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n/an/a 100n/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 Yes


(Homo sapiens (Human))
BDBM50137571
PNG
(3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydr...)
Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N4O3S/c1-24-31(29,30)15-10-11-21-18(13-15)19(23(28)26-21)14-22-17(8-6-12-27(2)3)16-7-4-5-9-20(16)25-22/h10-11,13-14,24-25H,4-9,12H2,1-3H3,(H,26,28)/b19-14-
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n/an/a 10n/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
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50137571
PNG
(3-[1-[3-(3-Dimethylamino-propyl)-4,5,6,7-tetrahydr...)
Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N4O3S/c1-24-31(29,30)15-10-11-21-18(13-15)19(23(28)26-21)14-22-17(8-6-12-27(2)3)16-7-4-5-9-20(16)25-22/h10-11,13-14,24-25H,4-9,12H2,1-3H3,(H,26,28)/b19-14-
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n/an/a 3.30E+3n/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