BDBM277983 2-((2S,4R)-4-hydroxy-2-methylpyrrolidin-1-yl)-5-(4-((4-(4-(oxetan-3-yl)piperazin-1-yl)phenyl)amino)-1,3,5-triazin-2-yl)benzonitrile::US10040781, Example 205::US10253019, Example 205

SMILES: C[C@H]1C[C@@H](O)CN1c1ccc(cc1C#N)-c1ncnc(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1

InChI Key: InChIKey=IYOHUZINNTYJDG-UQBPGWFLSA-N

Data: 6 IC50

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 6 hits for monomerid = 277983   

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
Protein cereblon/Serine/threonine-protein kinase TBK1 (Homo sapiens (Human))	BDBM277983 (2-((2S,4R)-4-hydroxy-2-methylpyrrolidin-1-yl)-5-(4...) Show SMILES C[C@H]1C[C@@H](O)CN1c1ccc(cc1C#N)-c1ncnc(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 |r| Show InChI InChI=1S/C28H32N8O2/c1-19-12-25(37)15-36(19)26-7-2-20(13-21(26)14-29)27-30-18-31-28(33-27)32-22-3-5-23(6-4-22)34-8-10-35(11-9-34)24-16-38-17-24/h2-7,13,18-19,24-25,37H,8-12,15-17H2,1H3,(H,30,31,32,33)/t19-,25+/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD 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
Inhibitor of nuclear factor kappa-B kinase subunit epsilon (Homo sapiens (Human))	BDBM277983 (2-((2S,4R)-4-hydroxy-2-methylpyrrolidin-1-yl)-5-(4...) Show SMILES C[C@H]1C[C@@H](O)CN1c1ccc(cc1C#N)-c1ncnc(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 |r| Show InChI InChI=1S/C28H32N8O2/c1-19-12-25(37)15-36(19)26-7-2-20(13-21(26)14-29)27-30-18-31-28(33-27)32-22-3-5-23(6-4-22)34-8-10-35(11-9-34)24-16-38-17-24/h2-7,13,18-19,24-25,37H,8-12,15-17H2,1H3,(H,30,31,32,33)/t19-,25+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.70E+4	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))	BDBM277983 (2-((2S,4R)-4-hydroxy-2-methylpyrrolidin-1-yl)-5-(4...) Show SMILES C[C@H]1C[C@@H](O)CN1c1ccc(cc1C#N)-c1ncnc(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 |r| Show InChI InChI=1S/C28H32N8O2/c1-19-12-25(37)15-36(19)26-7-2-20(13-21(26)14-29)27-30-18-31-28(33-27)32-22-3-5-23(6-4-22)34-8-10-35(11-9-34)24-16-38-17-24/h2-7,13,18-19,24-25,37H,8-12,15-17H2,1H3,(H,30,31,32,33)/t19-,25+/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	51	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
Protein cereblon/Serine/threonine-protein kinase TBK1 (Homo sapiens (Human))	BDBM277983 (2-((2S,4R)-4-hydroxy-2-methylpyrrolidin-1-yl)-5-(4...) Show SMILES C[C@H]1C[C@@H](O)CN1c1ccc(cc1C#N)-c1ncnc(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 |r| Show InChI InChI=1S/C28H32N8O2/c1-19-12-25(37)15-36(19)26-7-2-20(13-21(26)14-29)27-30-18-31-28(33-27)32-22-3-5-23(6-4-22)34-8-10-35(11-9-34)24-16-38-17-24/h2-7,13,18-19,24-25,37H,8-12,15-17H2,1H3,(H,30,31,32,33)/t19-,25+/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD 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
Inhibitor of nuclear factor kappa-B kinase subunit epsilon (Homo sapiens (Human))	BDBM277983 (2-((2S,4R)-4-hydroxy-2-methylpyrrolidin-1-yl)-5-(4...) Show SMILES C[C@H]1C[C@@H](O)CN1c1ccc(cc1C#N)-c1ncnc(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 |r| Show InChI InChI=1S/C28H32N8O2/c1-19-12-25(37)15-36(19)26-7-2-20(13-21(26)14-29)27-30-18-31-28(33-27)32-22-3-5-23(6-4-22)34-8-10-35(11-9-34)24-16-38-17-24/h2-7,13,18-19,24-25,37H,8-12,15-17H2,1H3,(H,30,31,32,33)/t19-,25+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	17	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))	BDBM277983 (2-((2S,4R)-4-hydroxy-2-methylpyrrolidin-1-yl)-5-(4...) Show SMILES C[C@H]1C[C@@H](O)CN1c1ccc(cc1C#N)-c1ncnc(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 |r| Show InChI InChI=1S/C28H32N8O2/c1-19-12-25(37)15-36(19)26-7-2-20(13-21(26)14-29)27-30-18-31-28(33-27)32-22-3-5-23(6-4-22)34-8-10-35(11-9-34)24-16-38-17-24/h2-7,13,18-19,24-25,37H,8-12,15-17H2,1H3,(H,30,31,32,33)/t19-,25+/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	5.10E+4	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