BDBM17051 BX-795::BX-795, 3::N-(3-{[5-iodo-4-({3-[(thiophen-2-ylcarbonyl)amino]propyl}amino)pyrimidin-2-yl]amino}phenyl)pyrrolidine-1-carboxamide::N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl]amino}pyrimidin-2-yl)amino]phenyl}pyrrolidine-1-carboxamide

SMILES: c1cc(cc(c1)NC(=O)N2CCCC2)Nc3ncc(c(n3)NCCCNC(=O)c4cccs4)I

InChI Key: InChIKey=VAVXGGRQQJZYBL-UHFFFAOYSA-N

Data: 12 IC50  3 Kd  1 EC50

PDB links: 9 PDB IDs match this monomer.

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 16 hits for monomerid = 17051   

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
3-phosphoinositide-dependent protein kinase 1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6	n/a	n/a	n/a	n/a	7.2	22
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3-phosphoinositide-dependent protein kinase 1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	26	n/a	n/a	n/a	n/a
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Cyclic GMP-AMP synthase (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase TBK1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase TBK1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase TBK1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase TBK1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase TBK1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
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Inhibitor of nuclear factor kappa-B kinase subunit epsilon (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
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NUAK family SNF1-like kinase 1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
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3-phosphoinositide-dependent protein kinase 1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase TBK1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
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Inhibitor of nuclear factor kappa-B kinase subunit epsilon (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
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[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase ULK2 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase ULK1 (Human)	BDBM17051 (N-{3-[(5-iodo-4-{[3-(thiophen-2-ylformamido)propyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
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