BDBM50400047 BIIB-057::CHEMBL2177736::US9579320, Example 87

SMILES: c1cc(cc(c1)n2nccn2)Nc3c(cnc(n3)N[C@@H]4CCCC[C@@H]4N)C(=O)N

InChI Key: InChIKey=TXGKRVFSSHPBAJ-UHFFFAOYSA-N

Data: 42 IC50

PDB links: 4 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 42 hits for monomerid = 50400047   

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
Tyrosine-protein kinase ZAP-70 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 3A4 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	952	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Lyn (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	238	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ZAP-70 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Tyrosine-protein kinase JAK2 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	178	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ZAP-70 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.81E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) 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
TBA									Citation and Details
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Protein kinase C alpha type (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	952	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	178	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	952	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	178	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	10.5	n/a	n/a	n/a	n/a	7.5	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Mitogen-activated protein kinase kinase kinase 9 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Tyrosine-protein kinase Fgr (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Yes (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	123	n/a	n/a	n/a	n/a	n/a	n/a
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Receptor-type tyrosine-protein kinase FLT3 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	139	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase PAK 5 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	166	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Lyn (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	199	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Proto-oncogene tyrosine-protein kinase Src (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	244	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Tyrosine-protein kinase Lck (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.5	n/a	n/a	n/a	n/a	7.5	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) 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
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Human)	BDBM50400047 (CHEMBL2177736 | BIIB-057 | US9579320, Example 87) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	223	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair