Compile Data Set for Download or QSAR

Found 634 hits Enz. Inhib. hit(s) with all data for entry = 11298   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385080 (US10287267, Compound 78 | US10508099, Compound 78 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCN(CC(C)(C)C)CC3)cc2c1 Show InChI InChI=1S/C24H31N5O/c1-24(2,3)16-29-9-7-17(8-10-29)23(30)27-22-12-20-11-18(5-6-19(20)13-25-22)21-14-26-28(4)15-21/h5-6,11-15,17H,7-10,16H2,1-4H3,(H,25,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	4.70	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385081 (US10287267, Compound 81 | US10508099, Compound 81 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCN(CCF)CC3)cc2c1 Show InChI InChI=1S/C21H24FN5O/c1-26-14-19(13-24-26)16-2-3-17-12-23-20(11-18(17)10-16)25-21(28)15-4-7-27(8-5-15)9-6-22/h2-3,10-15H,4-9H2,1H3,(H,23,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.5	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385082 (US10287267, Compound 304 | US10287267, Compound 82...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCN(CCC(F)(F)F)CC3)cc2c1 Show InChI InChI=1S/C22H24F3N5O/c1-29-14-19(13-27-29)16-2-3-17-12-26-20(11-18(17)10-16)28-21(31)15-4-7-30(8-5-15)9-6-22(23,24)25/h2-3,10-15H,4-9H2,1H3,(H,26,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	0.900	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385083 (US10287267, Compound 83 | US10508099, Compound 83 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCN(CC(C)(F)F)CC3)cc2c1 Show InChI InChI=1S/C22H25F2N5O/c1-22(23,24)14-29-7-5-15(6-8-29)21(30)27-20-10-18-9-16(3-4-17(18)11-25-20)19-12-26-28(2)13-19/h3-4,9-13,15H,5-8,14H2,1-2H3,(H,25,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.20	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385084 (US10287267, Compound 84 | US10508099, Compound 84 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCN(CC(F)F)CC3)cc2c1 Show InChI InChI=1S/C21H23F2N5O/c1-27-12-18(11-25-27)15-2-3-16-10-24-20(9-17(16)8-15)26-21(29)14-4-6-28(7-5-14)13-19(22)23/h2-3,8-12,14,19H,4-7,13H2,1H3,(H,24,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.30	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385085 (US10287267, Compound 85 | US10508099, Compound 85 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCN(CC(C)(C)F)CC3)cc2c1 Show InChI InChI=1S/C23H28FN5O/c1-23(2,24)15-29-8-6-16(7-9-29)22(30)27-21-11-19-10-17(4-5-18(19)12-25-21)20-13-26-28(3)14-20/h4-5,10-14,16H,6-9,15H2,1-3H3,(H,25,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.40	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385086 (US10287267, Compound 86 | US10508099, Compound 86 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCN(CC3)C3COC3)cc2c1 Show InChI InChI=1S/C22H25N5O2/c1-26-12-19(11-24-26)16-2-3-17-10-23-21(9-18(17)8-16)25-22(28)15-4-6-27(7-5-15)20-13-29-14-20/h2-3,8-12,15,20H,4-7,13-14H2,1H3,(H,23,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.5	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385087 (US10287267, Compound 87 | US10508099, Compound 87 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCN(CC4(C)COC4)CC3)cc2c1 Show InChI InChI=1S/C24H29N5O2/c1-24(15-31-16-24)14-29-7-5-17(6-8-29)23(30)27-22-10-20-9-18(3-4-19(20)11-25-22)21-12-26-28(2)13-21/h3-4,9-13,17H,5-8,14-16H2,1-2H3,(H,25,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3.30	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385088 (US10287267, Compound 89 | US10508099, Compound 89 ...) Show SMILES COCCN1CCC(CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1 Show InChI InChI=1S/C22H27N5O2/c1-26-15-20(14-24-26)17-3-4-18-13-23-21(12-19(18)11-17)25-22(28)16-5-7-27(8-6-16)9-10-29-2/h3-4,11-16H,5-10H2,1-2H3,(H,23,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.70	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385089 (US10287267, Compound 90 | US10508099, Compound 90 ...) Show SMILES CC(C)OCCN1CCC(CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1 Show InChI InChI=1S/C24H31N5O2/c1-17(2)31-11-10-29-8-6-18(7-9-29)24(30)27-23-13-21-12-19(4-5-20(21)14-25-23)22-15-26-28(3)16-22/h4-5,12-18H,6-11H2,1-3H3,(H,25,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385090 (US10287267, Compound 91 | US10508099, Compound 91 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3(F)CCNCC3)cc2c1 Show InChI InChI=1S/C19H20FN5O/c1-25-12-16(11-23-25)13-2-3-14-10-22-17(9-15(14)8-13)24-18(26)19(20)4-6-21-7-5-19/h2-3,8-12,21H,4-7H2,1H3,(H,22,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	10.5	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385091 (US10287267, Compound 92 | US10508099, Compound 92 ...) Show SMILES CN1CCC(F)(CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1 Show InChI InChI=1S/C20H22FN5O/c1-25-7-5-20(21,6-8-25)19(27)24-18-10-16-9-14(3-4-15(16)11-22-18)17-12-23-26(2)13-17/h3-4,9-13H,5-8H2,1-2H3,(H,22,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	6.5	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385092 (US10287267, Compound 96 | US10508099, Compound 96 ...) Show SMILES CC(C)CN1CCC(F)(CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1 Show InChI InChI=1S/C23H28FN5O/c1-16(2)14-29-8-6-23(24,7-9-29)22(30)27-21-11-19-10-17(4-5-18(19)12-25-21)20-13-26-28(3)15-20/h4-5,10-13,15-16H,6-9,14H2,1-3H3,(H,25,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	7.10	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385093 (US10287267, Compound 110 | US10508099, Compound 11...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)[C@H]3CCCNC3)cc2c1 |r| Show InChI InChI=1S/C19H21N5O/c1-24-12-17(11-22-24)13-4-5-14-10-21-18(8-16(14)7-13)23-19(25)15-3-2-6-20-9-15/h4-5,7-8,10-12,15,20H,2-3,6,9H2,1H3,(H,21,23,25)/t15-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	4.70	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385094 (US10287267, Compound 111 | US10508099, Compound 11...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)[C@@H]3CCCNC3)cc2c1 |r| Show InChI InChI=1S/C19H21N5O/c1-24-12-17(11-22-24)13-4-5-14-10-21-18(8-16(14)7-13)23-19(25)15-3-2-6-20-9-15/h4-5,7-8,10-12,15,20H,2-3,6,9H2,1H3,(H,21,23,25)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3.90	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385096 (US10287267, Compound 113 | US10508099, Compound 11...) Show SMILES CC(C)CN1CCC[C@H](C1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1 |r| Show InChI InChI=1S/C23H29N5O/c1-16(2)13-28-8-4-5-19(15-28)23(29)26-22-10-20-9-17(6-7-18(20)11-24-22)21-12-25-27(3)14-21/h6-7,9-12,14,16,19H,4-5,8,13,15H2,1-3H3,(H,24,26,29)/t19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	24.1	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385097 (US10287267, Compound 114 | US10508099, Compound 11...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)C3CCOCC3)cc2c1 Show InChI InChI=1S/C19H20N4O2/c1-23-12-17(11-21-23)14-2-3-15-10-20-18(9-16(15)8-14)22-19(24)13-4-6-25-7-5-13/h2-3,8-13H,4-7H2,1H3,(H,20,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.90	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385099 (US10287267, Compound 116 | US10508099, Compound 11...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)CN3CCC(F)CC3)cc2c1 Show InChI InChI=1S/C20H22FN5O/c1-25-12-17(11-23-25)14-2-3-15-10-22-19(9-16(15)8-14)24-20(27)13-26-6-4-18(21)5-7-26/h2-3,8-12,18H,4-7,13H2,1H3,(H,22,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	4.30	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385100 (US10287267, Compound 1014 | US10287267, Compound 1...) Show SMILES CN1CCN(CC(=O)Nc2cc3cc(ccc3cn2)-c2cnn(C)c2)CC1 Show InChI InChI=1S/C20H24N6O/c1-24-5-7-26(8-6-24)14-20(27)23-19-10-17-9-15(3-4-16(17)11-21-19)18-12-22-25(2)13-18/h3-4,9-13H,5-8,14H2,1-2H3,(H,21,23,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	9.60	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385102 (US10287267, Compound 120 | US10508099, Compound 12...) Show SMILES Cc1ncc(-c2ccc3cnc(NC(=O)C4CCCCC4)cc3c2)n1C Show InChI InChI=1S/C21H24N4O/c1-14-22-13-19(25(14)2)16-8-9-17-12-23-20(11-18(17)10-16)24-21(26)15-6-4-3-5-7-15/h8-13,15H,3-7H2,1-2H3,(H,23,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	4.80	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385104 (US10287267, Compound 188 | US10508099, Compound 18...) Show SMILES Cc1ncc(-c2ccc3cnc(NC(=O)[C@@H]4CCCO4)cc3c2)n1C |r| Show InChI InChI=1S/C19H20N4O2/c1-12-20-11-16(23(12)2)13-5-6-14-10-21-18(9-15(14)8-13)22-19(24)17-4-3-7-25-17/h5-6,8-11,17H,3-4,7H2,1-2H3,(H,21,22,24)/t17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	28.6	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385105 (US10287267, Compound 248 | US10508099, Compound 24...) Show SMILES Cn1nncc1-c1ccc2cnc(NC(=O)C3CCN(CCC(F)(F)F)CC3)cc2c1 Show InChI InChI=1S/C21H23F3N6O/c1-29-18(13-26-28-29)15-2-3-16-12-25-19(11-17(16)10-15)27-20(31)14-4-7-30(8-5-14)9-6-21(22,23)24/h2-3,10-14H,4-9H2,1H3,(H,25,27,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	37.4	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385107 (US10287267, Compound 263 | US10508099, Compound 26...) Show SMILES Cn1cncc1-c1ccc2cnc(NC(=O)C3CCC(F)(F)CC3)cc2c1 Show InChI InChI=1S/C20H20F2N4O/c1-26-12-23-11-17(26)14-2-3-15-10-24-18(9-16(15)8-14)25-19(27)13-4-6-20(21,22)7-5-13/h2-3,8-13H,4-7H2,1H3,(H,24,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.30	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385108 (US10287267, Compound 264 | US10508099, Compound 26...) Show SMILES CN1CCC(CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1ccn(C)n1 Show InChI InChI=1S/C20H23N5O/c1-24-8-5-14(6-9-24)20(26)22-19-12-17-11-15(3-4-16(17)13-21-19)18-7-10-25(2)23-18/h3-4,7,10-14H,5-6,8-9H2,1-2H3,(H,21,22,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	348	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385110 (US10287267, Compound 266 | US10508099, Compound 26...) Show SMILES CN1CCn2c(C1)ncc2-c1ccc2cnc(NC(=O)C3CC3)cc2c1 Show InChI InChI=1S/C20H21N5O/c1-24-6-7-25-17(11-22-19(25)12-24)14-4-5-15-10-21-18(9-16(15)8-14)23-20(26)13-2-3-13/h4-5,8-11,13H,2-3,6-7,12H2,1H3,(H,21,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	17.4	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385111 (US10287267, Compound 267 | US10508099, Compound 26...) Show SMILES CN1CCn2ncc(c2C1)-c1ccc2cnc(NC(=O)C3CC(F)(F)C3)cc2c1 Show InChI InChI=1S/C21H21F2N5O/c1-27-4-5-28-18(12-27)17(11-25-28)13-2-3-14-10-24-19(7-15(14)6-13)26-20(29)16-8-21(22,23)9-16/h2-3,6-7,10-11,16H,4-5,8-9,12H2,1H3,(H,24,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	29.4	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385113 (US10287267, Compound 269 | US10508099, Compound 26...) Show SMILES Cn1cncc1-c1ccc2cnc(NC(=O)C3C(C)(C)C3(C)C)cc2c1 Show InChI InChI=1S/C21H24N4O/c1-20(2)18(21(20,3)4)19(26)24-17-9-15-8-13(6-7-14(15)10-23-17)16-11-22-12-25(16)5/h6-12,18H,1-5H3,(H,23,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	5	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385114 (US10287267, Compound 270 | US10508099, Compound 27...) Show SMILES Cn1nccc1-c1ccc2cnc(NC(=O)C3CCN(CCC(F)(F)F)CC3)cc2c1 Show InChI InChI=1S/C22H24F3N5O/c1-29-19(4-8-27-29)16-2-3-17-14-26-20(13-18(17)12-16)28-21(31)15-5-9-30(10-6-15)11-7-22(23,24)25/h2-4,8,12-15H,5-7,9-11H2,1H3,(H,26,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	952	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385115 (US10287267, Compound 271 | US10508099, Compound 27...) Show SMILES Cn1cc(nn1)-c1ccc2cnc(NC(=O)C3CCN(CCC(F)(F)F)CC3)cc2c1 Show InChI InChI=1S/C21H23F3N6O/c1-29-13-18(27-28-29)15-2-3-16-12-25-19(11-17(16)10-15)26-20(31)14-4-7-30(8-5-14)9-6-21(22,23)24/h2-3,10-14H,4-9H2,1H3,(H,25,26,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.10	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385116 (US10287267, Compound 272 | US10508099, Compound 27...) Show SMILES CC(C)CN1CCN(CC(=O)Nc2cc3cc(ccc3cn2)-c2cnn(C)c2)CC1 Show InChI InChI=1S/C23H30N6O/c1-17(2)14-28-6-8-29(9-7-28)16-23(30)26-22-11-20-10-18(4-5-19(20)12-24-22)21-13-25-27(3)15-21/h4-5,10-13,15,17H,6-9,14,16H2,1-3H3,(H,24,26,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385117 (US10287267, Compound 273 | US10508099, Compound 27...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)CN3CC(C)(C)C3)cc2c1 Show InChI InChI=1S/C20H23N5O/c1-20(2)12-25(13-20)11-19(26)23-18-7-16-6-14(4-5-15(16)8-21-18)17-9-22-24(3)10-17/h4-10H,11-13H2,1-3H3,(H,21,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	10.7	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385189 (US10287267, Compound 351 | US10508099, Compound 35...) Show SMILES CCN1CCN(CC(=O)Nc2cc3cc(ccc3cn2)-c2cnn(C)c2)CC1 Show InChI InChI=1S/C21H26N6O/c1-3-26-6-8-27(9-7-26)15-21(28)24-20-11-18-10-16(4-5-17(18)12-22-20)19-13-23-25(2)14-19/h4-5,10-14H,3,6-9,15H2,1-2H3,(H,22,24,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	13.6	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385207 (US10287267, Compound 372 | US10508099, Compound 37...) Show SMILES CN1CCN(CC(=O)Nc2cc3cc(-c4cnn(C)c4)c(F)cc3cn2)CC1 Show InChI InChI=1S/C20H23FN6O/c1-25-3-5-27(6-4-25)13-20(28)24-19-9-14-7-17(16-11-23-26(2)12-16)18(21)8-15(14)10-22-19/h7-12H,3-6,13H2,1-2H3,(H,22,24,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	10.6	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385120 (US10287267, Compound 276 | US10508099, Compound 27...) Show SMILES Cn1cc(nn1)-c1ccc2cnc(NC(=O)CN3CCCCC3)cc2c1 Show InChI InChI=1S/C19H22N6O/c1-24-12-17(22-23-24)14-5-6-15-11-20-18(10-16(15)9-14)21-19(26)13-25-7-3-2-4-8-25/h5-6,9-12H,2-4,7-8,13H2,1H3,(H,20,21,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	5.10	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385121 (US10287267, Compound 277 | US10508099, Compound 27...) Show SMILES Cn1cc(nn1)-c1ccc2cnc(NC(=O)C3C(C)(C)C3(C)C)cc2c1 Show InChI InChI=1S/C20H23N5O/c1-19(2)17(20(19,3)4)18(26)22-16-9-14-8-12(6-7-13(14)10-21-16)15-11-25(5)24-23-15/h6-11,17H,1-5H3,(H,21,22,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.30	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385122 (US10287267, Compound 278 | US10508099, Compound 27...) Show SMILES Cn1cnnc1-c1ccc2cnc(NC(=O)C3CCN(CCC(F)(F)F)CC3)cc2c1 Show InChI InChI=1S/C21H23F3N6O/c1-29-13-26-28-19(29)15-2-3-16-12-25-18(11-17(16)10-15)27-20(31)14-4-7-30(8-5-14)9-6-21(22,23)24/h2-3,10-14H,4-9H2,1H3,(H,25,27,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	3.20	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385123 (US10287267, Compound 279 | US10508099, Compound 27...) Show SMILES Cc1nnc(-c2ccc3cnc(NC(=O)C4CCN(CCC(F)(F)F)CC4)cc3c2)n1C Show InChI InChI=1S/C22H25F3N6O/c1-14-28-29-20(30(14)2)16-3-4-17-13-26-19(12-18(17)11-16)27-21(32)15-5-8-31(9-6-15)10-7-22(23,24)25/h3-4,11-13,15H,5-10H2,1-2H3,(H,26,27,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	7.80	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385124 (US10287267, Compound 280 | US10508099, Compound 28...) Show SMILES CC(C)CN1CCC(F)(CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1nncn1C Show InChI InChI=1S/C22H27FN6O/c1-15(2)13-29-8-6-22(23,7-9-29)21(30)26-19-11-18-10-16(4-5-17(18)12-24-19)20-27-25-14-28(20)3/h4-5,10-12,14-15H,6-9,13H2,1-3H3,(H,24,26,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	10.8	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385125 (US10287267, Compound 281 | US10508099, Compound 28...) Show SMILES CC(C)CN1CCC(F)(CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1cn(C)nn1 Show InChI InChI=1S/C22H27FN6O/c1-15(2)13-29-8-6-22(23,7-9-29)21(30)25-20-11-18-10-16(4-5-17(18)12-24-20)19-14-28(3)27-26-19/h4-5,10-12,14-15H,6-9,13H2,1-3H3,(H,24,25,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	8.10	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385126 (US10287267, Compound 282 | US10508099, Compound 28...) Show SMILES CCN1CCC(F)(CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1cn(C)nn1 Show InChI InChI=1S/C20H23FN6O/c1-3-27-8-6-20(21,7-9-27)19(28)23-18-11-16-10-14(4-5-15(16)12-22-18)17-13-26(2)25-24-17/h4-5,10-13H,3,6-9H2,1-2H3,(H,22,23,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	11.5	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385127 (US10287267, Compound 283 | US10508099, Compound 28...) Show SMILES FCCN1CCn2ncc(c2C1)-c1ccc2cnc(NC(=O)C3CCC(F)(F)CC3)cc2c1 Show InChI InChI=1S/C24H26F3N5O/c25-7-8-31-9-10-32-21(15-31)20(14-29-32)17-1-2-18-13-28-22(12-19(18)11-17)30-23(33)16-3-5-24(26,27)6-4-16/h1-2,11-14,16H,3-10,15H2,(H,28,30,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	7	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385128 (US10287267, Compound 284 | US10287267, Compound 30...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)CN3CCCC3)cc2c1 Show InChI InChI=1S/C19H21N5O/c1-23-12-17(11-21-23)14-4-5-15-10-20-18(9-16(15)8-14)22-19(25)13-24-6-2-3-7-24/h4-5,8-12H,2-3,6-7,13H2,1H3,(H,20,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	7.10	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385129 (US10287267, Compound 285 | US10508099, Compound 28...) Show SMILES CCn1cc(cn1)-c1ccc2cnc(NC(=O)CN3CCCC3)cc2c1 Show InChI InChI=1S/C20H23N5O/c1-2-25-13-18(12-22-25)15-5-6-16-11-21-19(10-17(16)9-15)23-20(26)14-24-7-3-4-8-24/h5-6,9-13H,2-4,7-8,14H2,1H3,(H,21,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	44.2	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385130 (US10287267, Compound 286 | US10508099, Compound 28...) Show SMILES O=C(CN1CCCC1)Nc1cc2cc(ccc2cn1)-c1cnn(c1)C1CC1 Show InChI InChI=1S/C21H23N5O/c27-21(14-25-7-1-2-8-25)24-20-10-17-9-15(3-4-16(17)11-22-20)18-12-23-26(13-18)19-5-6-19/h3-4,9-13,19H,1-2,5-8,14H2,(H,22,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	64.9	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385131 (US10287267, Compound 287 | US10508099, Compound 28...) Show SMILES FC(F)(F)c1[nH]ncc1-c1ccc2cnc(NC(=O)CN3CCCC3)cc2c1 Show InChI InChI=1S/C19H18F3N5O/c20-19(21,22)18-15(10-24-26-18)12-3-4-13-9-23-16(8-14(13)7-12)25-17(28)11-27-5-1-2-6-27/h3-4,7-10H,1-2,5-6,11H2,(H,24,26)(H,23,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	5.14E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385132 (US10287267, Compound 288 | US10508099, Compound 28...) Show SMILES CC(N1CCCC1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1 Show InChI InChI=1S/C20H23N5O/c1-14(25-7-3-4-8-25)20(26)23-19-10-17-9-15(5-6-16(17)11-21-19)18-12-22-24(2)13-18/h5-6,9-14H,3-4,7-8H2,1-2H3,(H,21,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	27.3	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385208 (US10287267, Compound 376 | US10508099, Compound 37...) Show SMILES Cc1ncc(-c2ccc3cnc(NC(=O)C4(F)CC4)cc3c2)n1C Show InChI InChI=1S/C18H17FN4O/c1-11-20-10-15(23(11)2)12-3-4-13-9-21-16(8-14(13)7-12)22-17(24)18(19)5-6-18/h3-4,7-10H,5-6H2,1-2H3,(H,21,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	5.5	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385209 (US10287267, Compound 433 | US10508099, Compound 43...) Show SMILES Cn1cc(nn1)-c1ccc2cnc(NC(=O)C3CC3)cc2c1 Show InChI InChI=1S/C16H15N5O/c1-21-9-14(19-20-21)11-4-5-12-8-17-15(7-13(12)6-11)18-16(22)10-2-3-10/h4-10H,2-3H2,1H3,(H,17,18,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	1.90	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385210 (US10287267, Compound 441 | US10508099, Compound 44...) Show SMILES Cn1cc(nn1)-c1ccc2cnc(NC(=O)C3CCC(F)(F)CC3)cc2c1 Show InChI InChI=1S/C19H19F2N5O/c1-26-11-16(24-25-26)13-2-3-14-10-22-17(9-15(14)8-13)23-18(27)12-4-6-19(20,21)7-5-12/h2-3,8-12H,4-7H2,1H3,(H,22,23,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	9.10	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM385211 (US10287267, Compound 443 | US10508099, Compound 44...) Show SMILES CN(C)[C@H]1CC[C@@H](CC1)C(=O)Nc1cc2cc(ccc2cn1)-c1cn(C)nn1 |r,wU:3.2,wD:6.9,(9.19,1.16,;7.85,1.93,;7.85,3.47,;6.52,1.15,;6.52,-.38,;5.19,-1.15,;3.85,-.38,;3.85,1.15,;5.19,1.93,;2.52,-1.15,;2.52,-2.69,;1.18,-.38,;-.15,-1.15,;-1.48,-.38,;-2.82,-1.15,;-4.15,-.38,;-5.48,-1.15,;-5.48,-2.69,;-4.15,-3.47,;-2.82,-2.69,;-1.48,-3.47,;-.15,-2.69,;-6.82,-.38,;-6.82,1.15,;-8.28,1.63,;-9.05,2.96,;-9.19,.38,;-8.28,-.86,)| Show InChI InChI=1S/C21H26N6O/c1-26(2)18-8-6-14(7-9-18)21(28)23-20-11-17-10-15(4-5-16(17)12-22-20)19-13-27(3)25-24-19/h4-5,10-14,18H,6-9H2,1-3H3,(H,22,23,28)/t14-,18-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	2.20	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q25X2DVD
					More data for this Ligand-Target Pair

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