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SMILES: CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1

InChI Key: InChIKey=RSWVUHGRSKMXFQ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 387839   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Blk (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Fgr (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Tyrosine-protein kinase FRK (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Fyn (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Tyrosine-protein kinase HCK (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Yes (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Lck (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Lyn (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Platelet-derived growth factor receptor alpha (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair
Mast/stem cell growth factor receptor Kit (Homo sapiens (Human))	BDBM387839 (US10294227, Code 103) Show SMILES CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1 Show InChI InChI=1S/C19H25N7/c1-14-3-5-15(6-4-14)17-16-18(20)21-13-22-19(16)26(23-17)12-11-25-9-7-24(2)8-10-25/h3-6,13H,7-12H2,1-2H3,(H2,20,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Compound IC50 values were determined from 10-point, 1:3 dilution curves starting at either 100 μM or 10 μM with 10 μM ATP, by Reaction...				Bioorg Med Chem Lett 19: 773-7 (2009) BindingDB Entry DOI: 10.7270/Q27D2XFP
					More data for this Ligand-Target Pair