null

SMILES: C[C@H](O)C(=O)N1CC[C@H](Oc2ccc(cc2C#N)-c2ncnc(Nc3ccc(cc3)N3CCN(CCO)CC3)n2)[C@H](F)C1

InChI Key: InChIKey=XNGKZCMFTYVTSV-FESMNKHTSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 278361   

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
Serine/threonine-protein kinase TBK1 (Homo sapiens (Human))	BDBM278361 (2-(((3R,4S)-3-fluoro-1-((S)-2-hydroxypropanoyl)pip...) Show SMILES C[C@H](O)C(=O)N1CC[C@H](Oc2ccc(cc2C#N)-c2ncnc(Nc3ccc(cc3)N3CCN(CCO)CC3)n2)[C@H](F)C1 |r| Show InChI InChI=1S/C30H35FN8O4/c1-20(41)29(42)39-9-8-27(25(31)18-39)43-26-7-2-21(16-22(26)17-32)28-33-19-34-30(36-28)35-23-3-5-24(6-4-23)38-12-10-37(11-13-38)14-15-40/h2-7,16,19-20,25,27,40-41H,8-15,18H2,1H3,(H,33,34,35,36)/t20-,25+,27-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	7.0	n/a
Gilead Sciences, Inc. US Patent					Assay Description Enzymatic activity of IKKε and TBK1 was measured using a homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay that m...				US Patent US10040781 (2018) BindingDB Entry DOI: 10.7270/Q22V2J41
					More data for this Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit epsilon (Homo sapiens (Human))	BDBM278361 (2-(((3R,4S)-3-fluoro-1-((S)-2-hydroxypropanoyl)pip...) Show SMILES C[C@H](O)C(=O)N1CC[C@H](Oc2ccc(cc2C#N)-c2ncnc(Nc3ccc(cc3)N3CCN(CCO)CC3)n2)[C@H](F)C1 |r| Show InChI InChI=1S/C30H35FN8O4/c1-20(41)29(42)39-9-8-27(25(31)18-39)43-26-7-2-21(16-22(26)17-32)28-33-19-34-30(36-28)35-23-3-5-24(6-4-23)38-12-10-37(11-13-38)14-15-40/h2-7,16,19-20,25,27,40-41H,8-15,18H2,1H3,(H,33,34,35,36)/t20-,25+,27-/m0/s1	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	7.0	n/a
Gilead Sciences, Inc. US Patent					Assay Description Enzymatic activity of IKKε and TBK1 was measured using a homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay that m...				US Patent US10040781 (2018) BindingDB Entry DOI: 10.7270/Q22V2J41
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM278361 (2-(((3R,4S)-3-fluoro-1-((S)-2-hydroxypropanoyl)pip...) Show SMILES C[C@H](O)C(=O)N1CC[C@H](Oc2ccc(cc2C#N)-c2ncnc(Nc3ccc(cc3)N3CCN(CCO)CC3)n2)[C@H](F)C1 |r| Show InChI InChI=1S/C30H35FN8O4/c1-20(41)29(42)39-9-8-27(25(31)18-39)43-26-7-2-21(16-22(26)17-32)28-33-19-34-30(36-28)35-23-3-5-24(6-4-23)38-12-10-37(11-13-38)14-15-40/h2-7,16,19-20,25,27,40-41H,8-15,18H2,1H3,(H,33,34,35,36)/t20-,25+,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	479	n/a	n/a	n/a	n/a	n/a	n/a
University of Rome La Sapienza					Assay Description Enzymatic activity of hJAK2 was measured using a LANCE homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay that monitors...				J Med Chem 50: 6554-69 (2007) BindingDB Entry DOI: 10.7270/Q2Q52RXT
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase TBK1 (Homo sapiens (Human))	BDBM278361 (2-(((3R,4S)-3-fluoro-1-((S)-2-hydroxypropanoyl)pip...) Show SMILES C[C@H](O)C(=O)N1CC[C@H](Oc2ccc(cc2C#N)-c2ncnc(Nc3ccc(cc3)N3CCN(CCO)CC3)n2)[C@H](F)C1 |r| Show InChI InChI=1S/C30H35FN8O4/c1-20(41)29(42)39-9-8-27(25(31)18-39)43-26-7-2-21(16-22(26)17-32)28-33-19-34-30(36-28)35-23-3-5-24(6-4-23)38-12-10-37(11-13-38)14-15-40/h2-7,16,19-20,25,27,40-41H,8-15,18H2,1H3,(H,33,34,35,36)/t20-,25+,27-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
University of Rome La Sapienza					Assay Description Enzymatic activity of IKKε and TBK1 was measured using a homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay that m...				J Med Chem 50: 6554-69 (2007) BindingDB Entry DOI: 10.7270/Q2Q52RXT
					More data for this Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit epsilon (Homo sapiens (Human))	BDBM278361 (2-(((3R,4S)-3-fluoro-1-((S)-2-hydroxypropanoyl)pip...) Show SMILES C[C@H](O)C(=O)N1CC[C@H](Oc2ccc(cc2C#N)-c2ncnc(Nc3ccc(cc3)N3CCN(CCO)CC3)n2)[C@H](F)C1 |r| Show InChI InChI=1S/C30H35FN8O4/c1-20(41)29(42)39-9-8-27(25(31)18-39)43-26-7-2-21(16-22(26)17-32)28-33-19-34-30(36-28)35-23-3-5-24(6-4-23)38-12-10-37(11-13-38)14-15-40/h2-7,16,19-20,25,27,40-41H,8-15,18H2,1H3,(H,33,34,35,36)/t20-,25+,27-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
University of Rome La Sapienza					Assay Description Enzymatic activity of IKKε and TBK1 was measured using a homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay that m...				J Med Chem 50: 6554-69 (2007) BindingDB Entry DOI: 10.7270/Q2Q52RXT
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM278361 (2-(((3R,4S)-3-fluoro-1-((S)-2-hydroxypropanoyl)pip...) Show SMILES C[C@H](O)C(=O)N1CC[C@H](Oc2ccc(cc2C#N)-c2ncnc(Nc3ccc(cc3)N3CCN(CCO)CC3)n2)[C@H](F)C1 |r| Show InChI InChI=1S/C30H35FN8O4/c1-20(41)29(42)39-9-8-27(25(31)18-39)43-26-7-2-21(16-22(26)17-32)28-33-19-34-30(36-28)35-23-3-5-24(6-4-23)38-12-10-37(11-13-38)14-15-40/h2-7,16,19-20,25,27,40-41H,8-15,18H2,1H3,(H,33,34,35,36)/t20-,25+,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.79E+5	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Sciences, Inc. US Patent					Assay Description Enzymatic activity of hJAK2 was measured using a LANCE homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay that monitors...				US Patent US10040781 (2018) BindingDB Entry DOI: 10.7270/Q22V2J41
					More data for this Ligand-Target Pair