null

SMILES: C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C

InChI Key: InChIKey=NLELAZOVYOFQNL-MGPUTAFESA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 475648   

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 JAK3 (Homo sapiens (Human))	BDBM475648 (US10851102, Example 41 | US11339160, Ex No. 41) Show SMILES C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r| Show InChI InChI=1S/C22H23N3O3/c1-3-22(27)24-9-8-20(15(2)12-24)28-21-10-17(13-25-14-23-11-19(21)25)16-4-6-18(26)7-5-16/h3-7,10-11,13-15,20,26H,1,8-9,12H2,2H3/t15-,20+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A panel of four LanthaScreen JAK biochemical assays (JAK1, 2, 3 and Tyk2) were carried in a common kinase reaction buffer (50 mM HEPES, pH 7.5, 0.01%...				Citation and Details BindingDB Entry DOI: 10.7270/Q2CF9T9W
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM475648 (US10851102, Example 41 | US11339160, Ex No. 41) Show SMILES C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r| Show InChI InChI=1S/C22H23N3O3/c1-3-22(27)24-9-8-20(15(2)12-24)28-21-10-17(13-25-14-23-11-19(21)25)16-4-6-18(26)7-5-16/h3-7,10-11,13-15,20,26H,1,8-9,12H2,2H3/t15-,20+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Theravance Biopharma R&D IP, LLC US Patent									US Patent US10851102 (2020) BindingDB Entry DOI: 10.7270/Q2N87DV3
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM475648 (US10851102, Example 41 | US11339160, Ex No. 41) Show SMILES C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r| Show InChI InChI=1S/C22H23N3O3/c1-3-22(27)24-9-8-20(15(2)12-24)28-21-10-17(13-25-14-23-11-19(21)25)16-4-6-18(26)7-5-16/h3-7,10-11,13-15,20,26H,1,8-9,12H2,2H3/t15-,20+/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A panel of four LanthaScreen JAK biochemical assays (JAK1, 2, 3 and Tyk2) were carried in a common kinase reaction buffer (50 mM HEPES, pH 7.5, 0.01%...				Citation and Details BindingDB Entry DOI: 10.7270/Q2CF9T9W
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM475648 (US10851102, Example 41 | US11339160, Ex No. 41) Show SMILES C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r| Show InChI InChI=1S/C22H23N3O3/c1-3-22(27)24-9-8-20(15(2)12-24)28-21-10-17(13-25-14-23-11-19(21)25)16-4-6-18(26)7-5-16/h3-7,10-11,13-15,20,26H,1,8-9,12H2,2H3/t15-,20+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A panel of four LanthaScreen JAK biochemical assays (JAK1, 2, 3 and Tyk2) were carried in a common kinase reaction buffer (50 mM HEPES, pH 7.5, 0.01%...				Citation and Details BindingDB Entry DOI: 10.7270/Q2CF9T9W
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM475648 (US10851102, Example 41 | US11339160, Ex No. 41) Show SMILES C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r| Show InChI InChI=1S/C22H23N3O3/c1-3-22(27)24-9-8-20(15(2)12-24)28-21-10-17(13-25-14-23-11-19(21)25)16-4-6-18(26)7-5-16/h3-7,10-11,13-15,20,26H,1,8-9,12H2,2H3/t15-,20+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A panel of four LanthaScreen JAK biochemical assays (JAK1, 2, 3 and Tyk2) were carried in a common kinase reaction buffer (50 mM HEPES, pH 7.5, 0.01%...				Citation and Details BindingDB Entry DOI: 10.7270/Q2CF9T9W
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM475648 (US10851102, Example 41 | US11339160, Ex No. 41) Show SMILES C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r| Show InChI InChI=1S/C22H23N3O3/c1-3-22(27)24-9-8-20(15(2)12-24)28-21-10-17(13-25-14-23-11-19(21)25)16-4-6-18(26)7-5-16/h3-7,10-11,13-15,20,26H,1,8-9,12H2,2H3/t15-,20+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Theravance Biopharma R&D IP, LLC US Patent									US Patent US10851102 (2020) BindingDB Entry DOI: 10.7270/Q2N87DV3
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM475648 (US10851102, Example 41 | US11339160, Ex No. 41) Show SMILES C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r| Show InChI InChI=1S/C22H23N3O3/c1-3-22(27)24-9-8-20(15(2)12-24)28-21-10-17(13-25-14-23-11-19(21)25)16-4-6-18(26)7-5-16/h3-7,10-11,13-15,20,26H,1,8-9,12H2,2H3/t15-,20+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Theravance Biopharma R&D IP, LLC US Patent					Assay Description A panel of four LanthaScreen JAK biochemical assays (JAK1, 2, 3 and Tyk2) were carried in a common kinase reaction buffer (50 mM HEPES, pH 7.5, 0.01%...				US Patent US10851102 (2020) BindingDB Entry DOI: 10.7270/Q2N87DV3
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM475648 (US10851102, Example 41 | US11339160, Ex No. 41) Show SMILES C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r| Show InChI InChI=1S/C22H23N3O3/c1-3-22(27)24-9-8-20(15(2)12-24)28-21-10-17(13-25-14-23-11-19(21)25)16-4-6-18(26)7-5-16/h3-7,10-11,13-15,20,26H,1,8-9,12H2,2H3/t15-,20+/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Theravance Biopharma R&D IP, LLC US Patent									US Patent US10851102 (2020) BindingDB Entry DOI: 10.7270/Q2N87DV3
					More data for this Ligand-Target Pair