BDBM50307768 7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-yloxy)-N-hydroxyheptanamide::CHEMBL598797::CUDC-101

SMILES: COc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCCCCCC(=O)NO

InChI Key: InChIKey=PLIVFNIUGLLCEK-UHFFFAOYSA-N

Data: 34 IC50  1 Kd

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 35 hits for monomerid = 50307768   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Proto-oncogene tyrosine-protein kinase receptor Ret (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Polyamine deacetylase HDAC10 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
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Vascular endothelial growth factor receptor 2 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	849	n/a	n/a	n/a	n/a	n/a	n/a
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Proto-oncogene tyrosine-protein kinase Src (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Lyn (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Lck (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.91E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase ABL1 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.89E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Fibroblast growth factor receptor 2 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Receptor-type tyrosine-protein kinase FLT3 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 9 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	67	n/a	n/a	n/a	n/a	n/a	n/a
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Epidermal growth factor receptor (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
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Receptor tyrosine-protein kinase erbB-2 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
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Epidermal growth factor receptor (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
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Receptor tyrosine-protein kinase erbB-2 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
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Epidermal growth factor receptor (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
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Receptor tyrosine-protein kinase erbB-2 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
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Leukotriene A-4 hydrolase (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Leukotriene A-4 hydrolase (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 5 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
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Receptor tyrosine-protein kinase erbB-2 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
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Epidermal growth factor receptor (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Histone deacetylase (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Polyamine deacetylase HDAC10 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Polyamine deacetylase HDAC10 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	398	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Histone deacetylase (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
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Ferrochelatase, mitochondrial [R115L] (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 1 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 2 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 3 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.10	n/a	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 8 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 4 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 6 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.10	n/a	n/a	n/a	n/a	n/a	n/a
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Histone deacetylase 7 (Human)	BDBM50307768 (7-(4-(3-Ethynylphenylamino)-7-methoxyquinazolin-6-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	373	n/a	n/a	n/a	n/a	n/a	n/a
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