Compile Data Set for Download or QSAR

Found 52 hits Enz. Inhib. hit(s) with all data for entry = 50049193   

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
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236077 (CHEMBL4099855) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C Show InChI InChI=1S/C32H28F3N7O3/c1-5-27(43)39-25-14-23(11-9-18(25)2)38-30-36-16-21-17-42(31(45)41(4)28(21)40-30)26-15-24(12-10-19(26)3)37-29(44)20-7-6-8-22(13-20)32(33,34)35/h5-16H,1,17H2,2-4H3,(H,37,44)(H,39,43)(H,36,38,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50323777 (CHEMBL1214141 | N-(4-Methyl-3-(1-methyl-7-(6-methy...) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)nc3)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C Show InChI InChI=1S/C28H24F3N7O2/c1-16-7-9-21(34-25(39)18-5-4-6-20(11-18)28(29,30)31)12-23(16)38-15-19-13-33-26(36-24(19)37(3)27(38)40)35-22-10-8-17(2)32-14-22/h4-14H,15H2,1-3H3,(H,34,39)(H,33,35,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM102620 (BMX-IN-1 | N-[5-[9-[4-(methanesulfonamido)phenyl]-...) Show SMILES Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc(NS(C)(=O)=O)cc1 Show InChI InChI=1S/C29H24N4O4S/c1-4-27(34)31-26-16-23(12-5-18(26)2)33-28(35)14-9-21-17-30-25-13-8-20(15-24(25)29(21)33)19-6-10-22(11-7-19)32-38(3,36)37/h4-17,32H,1H2,2-3H3,(H,31,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BTK expressed in baculovirus expression system by Z'-LYTE assay				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236044 (CHEMBL4066104) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C Show InChI InChI=1S/C33H35N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h8-17H,1H2,2-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236076 (CHEMBL4098823) Show SMILES CC(C)C[C@H](N)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O |r| Show InChI InChI=1S/C30H36N8O3/c1-7-26(39)35-24-13-21(10-8-18(24)4)34-29-32-15-20-16-38(30(41)37(6)27(20)36-29)25-14-22(11-9-19(25)5)33-28(40)23(31)12-17(2)3/h7-11,13-15,17,23H,1,12,16,31H2,2-6H3,(H,33,40)(H,35,39)(H,32,34,36)/t23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236072 (CHEMBL4064566) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C Show InChI InChI=1S/C31H28F3N7O3/c1-5-26(42)39-24-15-22(12-10-17(24)2)38-30-36-16-23(27(35-4)41-30)29(44)40-25-14-21(11-9-18(25)3)37-28(43)19-7-6-8-20(13-19)31(32,33)34/h5-16H,1H2,2-4H3,(H,37,43)(H,39,42)(H,40,44)(H2,35,36,38,41)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibitory activity against radioligand [3H]paroxetine binding at the serotonin transporter				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236032 (CHEMBL4095181) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(ccc1C)C(=O)Nc1cccc(c1)C(F)(F)F Show InChI InChI=1S/C31H28F3N7O3/c1-5-26(42)39-25-15-22(12-10-18(25)3)38-30-36-16-23(27(35-4)41-30)29(44)40-24-13-19(11-9-17(24)2)28(43)37-21-8-6-7-20(14-21)31(32,33)34/h5-16H,1H2,2-4H3,(H,37,43)(H,39,42)(H,40,44)(H2,35,36,38,41)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	86	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50236033 (CHEMBL4087478) Show SMILES CCC(=O)Nc1cc(Nc2ncc(C(=O)Nc3cc(NC(=O)c4cc(OC)c(OC)c(OC)c4)ccc3C)c(NC)n2)ccc1C Show InChI InChI=1S/C33H37N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h9-17H,8H2,1-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human GST-tagged p38alpha expressed in Escherichia coli by Z'-LYTE assay				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236041 (CHEMBL4093840) Show SMILES CCC(=O)Nc1cc(Nc2ncc(C(=O)Nc3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)c(NC)n2)ccc1C Show InChI InChI=1S/C31H30F3N7O3/c1-5-26(42)39-24-15-22(12-10-17(24)2)38-30-36-16-23(27(35-4)41-30)29(44)40-25-14-21(11-9-18(25)3)37-28(43)19-7-6-8-20(13-19)31(32,33)34/h6-16H,5H2,1-4H3,(H,37,43)(H,39,42)(H,40,44)(H2,35,36,38,41)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	102	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50236044 (CHEMBL4066104) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C Show InChI InChI=1S/C33H35N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h8-17H,1H2,2-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	106	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human GST-tagged p38alpha expressed in Escherichia coli by Z'-LYTE assay				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236073 (CHEMBL4090174) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)c2cc(C)ccc2F)ccc1C Show InChI InChI=1S/C32H30FN7O3/c1-6-28(41)37-26-14-22(10-8-19(26)3)36-31-34-16-21-17-40(32(43)39(5)29(21)38-31)27-15-23(11-9-20(27)4)35-30(42)24-13-18(2)7-12-25(24)33/h6-16H,1,17H2,2-5H3,(H,35,42)(H,37,41)(H,34,36,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236031 (CHEMBL4074708) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cc(C)ccc2F)ccc1C Show InChI InChI=1S/C31H30FN7O3/c1-6-27(40)37-25-15-21(11-9-18(25)3)36-31-34-16-23(28(33-5)39-31)30(42)38-26-14-20(10-8-19(26)4)35-29(41)22-13-17(2)7-12-24(22)32/h6-16H,1H2,2-5H3,(H,35,41)(H,37,40)(H,38,42)(H2,33,34,36,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	133	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Epithelial discoidin domain-containing receptor 1 (Homo sapiens (Human))	BDBM50236033 (CHEMBL4087478) Show SMILES CCC(=O)Nc1cc(Nc2ncc(C(=O)Nc3cc(NC(=O)c4cc(OC)c(OC)c(OC)c4)ccc3C)c(NC)n2)ccc1C Show InChI InChI=1S/C33H37N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h9-17H,8H2,1-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	212	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of human GST-tagged DDR1 catalytic domain expressed in baculovirus expression system by LanthaScreen assay				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236080 (CHEMBL4103856) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cc(OC)cc(OC)c2)ccc1C Show InChI InChI=1S/C32H33N7O5/c1-7-28(40)37-26-15-22(11-9-18(26)2)36-32-34-17-25(29(33-4)39-32)31(42)38-27-14-21(10-8-19(27)3)35-30(41)20-12-23(43-5)16-24(13-20)44-6/h7-17H,1H2,2-6H3,(H,35,41)(H,37,40)(H,38,42)(H2,33,34,36,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	225	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibitory activity against radioligand [3H]WIN-35428 binding at the dopamine transporter				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236033 (CHEMBL4087478) Show SMILES CCC(=O)Nc1cc(Nc2ncc(C(=O)Nc3cc(NC(=O)c4cc(OC)c(OC)c(OC)c4)ccc3C)c(NC)n2)ccc1C Show InChI InChI=1S/C33H37N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h9-17H,8H2,1-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Epithelial discoidin domain-containing receptor 1 (Homo sapiens (Human))	BDBM50236044 (CHEMBL4066104) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C Show InChI InChI=1S/C33H35N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h8-17H,1H2,2-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	265	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibitory activity against radioligand [3H]WIN-35428 binding at the dopamine transporter				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236087 (CHEMBL4079601) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2ccc3OCCOc3c2)ccc1C Show InChI InChI=1S/C32H31N7O5/c1-5-28(40)37-24-16-22(10-7-18(24)2)36-32-34-17-23(29(33-4)39-32)31(42)38-25-15-21(9-6-19(25)3)35-30(41)20-8-11-26-27(14-20)44-13-12-43-26/h5-11,14-17H,1,12-13H2,2-4H3,(H,35,41)(H,37,40)(H,38,42)(H2,33,34,36,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	279	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236035 (CHEMBL4059791) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)c2ccc3OCOc3c2)ccc1C Show InChI InChI=1S/C32H29N7O5/c1-5-28(40)36-24-13-22(9-6-18(24)2)35-31-33-15-21-16-39(32(42)38(4)29(21)37-31)25-14-23(10-7-19(25)3)34-30(41)20-8-11-26-27(12-20)44-17-43-26/h5-15H,1,16-17H2,2-4H3,(H,34,41)(H,36,40)(H,33,35,37)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	382	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Antagonist activity against hPR (human progesterone receptor) compared to that of progesterone (100%)				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM50236044 (CHEMBL4066104) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C Show InChI InChI=1S/C33H35N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h8-17H,1H2,2-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	437	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BTK expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236047 (CHEMBL4069109) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)c2c(C)cccc2F)ccc1C Show InChI InChI=1S/C32H30FN7O3/c1-6-27(41)37-25-14-22(12-10-18(25)2)36-31-34-16-21-17-40(32(43)39(5)29(21)38-31)26-15-23(13-11-19(26)3)35-30(42)28-20(4)8-7-9-24(28)33/h6-16H,1,17H2,2-5H3,(H,35,42)(H,37,41)(H,34,36,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236030 (CHEMBL4084978) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(ccc1C)C(=O)Nc1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C33H35N7O6/c1-8-28(41)38-25-14-21(12-10-19(25)3)37-33-35-17-23(30(34-4)40-33)32(43)39-24-13-20(11-9-18(24)2)31(42)36-22-15-26(44-5)29(46-7)27(16-22)45-6/h8-17H,1H2,2-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236026 (CHEMBL4072976) Show SMILES COc1ccccc1C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O Show InChI InChI=1S/C32H31N7O4/c1-6-28(40)36-25-15-22(13-11-19(25)2)35-31-33-17-21-18-39(32(42)38(4)29(21)37-31)26-16-23(14-12-20(26)3)34-30(41)24-9-7-8-10-27(24)43-5/h6-17H,1,18H2,2-5H3,(H,34,41)(H,36,40)(H,33,35,37)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	591	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236028 (CHEMBL4065746) Show SMILES COc1ccc(cc1OC)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O Show InChI InChI=1S/C33H33N7O5/c1-7-29(41)37-25-15-23(11-8-19(25)2)36-32-34-17-22-18-40(33(43)39(4)30(22)38-32)26-16-24(12-9-20(26)3)35-31(42)21-10-13-27(44-5)28(14-21)45-6/h7-17H,1,18H2,2-6H3,(H,35,42)(H,37,41)(H,34,36,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	637	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Antagonist activity against hPR (human progesterone receptor) compared to that of progesterone (100%)				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236037 (CHEMBL4098220) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)c2ccc3CCCCc3c2)ccc1C Show InChI InChI=1S/C35H35N7O3/c1-5-31(43)39-29-17-27(14-10-21(29)2)38-34-36-19-26-20-42(35(45)41(4)32(26)40-34)30-18-28(15-11-22(30)3)37-33(44)25-13-12-23-8-6-7-9-24(23)16-25/h5,10-19H,1,6-9,20H2,2-4H3,(H,37,44)(H,39,43)(H,36,38,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	813	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236042 (CHEMBL4103547) Show SMILES COc1ccc(C(=O)Nc2ccc(C)c(c2)N2Cc3cnc(Nc4ccc(C)c(NC(=O)C=C)c4)nc3N(C)C2=O)c(OC)c1 Show InChI InChI=1S/C33H33N7O5/c1-7-29(41)37-26-14-22(10-8-19(26)2)36-32-34-17-21-18-40(33(43)39(4)30(21)38-32)27-15-23(11-9-20(27)3)35-31(42)25-13-12-24(44-5)16-28(25)45-6/h7-17H,1,18H2,2-6H3,(H,35,42)(H,37,41)(H,34,36,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	927	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236029 (CHEMBL4079282) Show SMILES COc1cc(OC)cc(c1)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O Show InChI InChI=1S/C33H33N7O5/c1-7-29(41)37-27-14-23(10-8-19(27)2)36-32-34-17-22-18-40(33(43)39(4)30(22)38-32)28-15-24(11-9-20(28)3)35-31(42)21-12-25(44-5)16-26(13-21)45-6/h7-17H,1,18H2,2-6H3,(H,35,42)(H,37,41)(H,34,36,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Agonist activity was determined against hPR (human progesterone receptor) compared to that of progesterone (100%)				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236036 (CHEMBL4088068) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)c2ccc3OCCOc3c2)ccc1C Show InChI InChI=1S/C33H31N7O5/c1-5-29(41)37-25-15-23(9-6-19(25)2)36-32-34-17-22-18-40(33(43)39(4)30(22)38-32)26-16-24(10-7-20(26)3)35-31(42)21-8-11-27-28(14-21)45-13-12-44-27/h5-11,14-17H,1,12-13,18H2,2-4H3,(H,35,42)(H,37,41)(H,34,36,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Agonist activity was determined against hPR (human progesterone receptor) compared to that of progesterone (100%)				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236043 (CHEMBL4068448) Show SMILES COc1ccc(OC)c(c1)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O Show InChI InChI=1S/C33H33N7O5/c1-7-29(41)37-26-14-22(10-8-19(26)2)36-32-34-17-21-18-40(33(43)39(4)30(21)38-32)27-15-23(11-9-20(27)3)35-31(42)25-16-24(44-5)12-13-28(25)45-6/h7-17H,1,18H2,2-6H3,(H,35,42)(H,37,41)(H,34,36,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibitory activity against radioligand [3H]paroxetine binding at the serotonin transporter				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236027 (CHEMBL4087169) Show SMILES COc1ccc(cc1)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O Show InChI InChI=1S/C32H31N7O4/c1-6-28(40)36-26-15-23(11-7-19(26)2)35-31-33-17-22-18-39(32(42)38(4)29(22)37-31)27-16-24(12-8-20(27)3)34-30(41)21-9-13-25(43-5)14-10-21/h6-17H,1,18H2,2-5H3,(H,34,41)(H,36,40)(H,33,35,37)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.54E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236088 (CHEMBL4079864) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)ccc1C Show InChI InChI=1S/C33H27F6N7O3/c1-5-27(47)43-25-13-23(8-6-17(25)2)42-30-40-15-20-16-46(31(49)45(4)28(20)44-30)26-14-24(9-7-18(26)3)41-29(48)19-10-21(32(34,35)36)12-22(11-19)33(37,38)39/h5-15H,1,16H2,2-4H3,(H,41,48)(H,43,47)(H,40,42,44)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.54E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236085 (CHEMBL4082327) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)[C@@H](N)Cc2cc3ccccc3[nH]2)ccc1C |r| Show InChI InChI=1S/C35H35N9O3/c1-5-31(45)41-29-16-24(12-10-20(29)2)40-34-37-18-23-19-44(35(47)43(4)32(23)42-34)30-17-25(13-11-21(30)3)39-33(46)27(36)15-26-14-22-8-6-7-9-28(22)38-26/h5-14,16-18,27,38H,1,15,19,36H2,2-4H3,(H,39,46)(H,41,45)(H,37,40,42)/t27-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.37E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236075 (CHEMBL4073152) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cccc(OC)c2)ccc1C Show InChI InChI=1S/C31H31N7O4/c1-6-27(39)36-25-16-22(13-11-18(25)2)35-31-33-17-24(28(32-4)38-31)30(41)37-26-15-21(12-10-19(26)3)34-29(40)20-8-7-9-23(14-20)42-5/h6-17H,1H2,2-5H3,(H,34,40)(H,36,39)(H,37,41)(H2,32,33,35,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibitory activity against radioligand [3H]WIN-35428 binding at the dopamine transporter				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236071 (CHEMBL4083564) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2ccc(OC)cc2)ccc1C Show InChI InChI=1S/C31H31N7O4/c1-6-27(39)36-25-16-22(12-8-18(25)2)35-31-33-17-24(28(32-4)38-31)30(41)37-26-15-21(11-7-19(26)3)34-29(40)20-9-13-23(42-5)14-10-20/h6-17H,1H2,2-5H3,(H,34,40)(H,36,39)(H,37,41)(H2,32,33,35,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236038 (CHEMBL4080192) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)c2ccc(C)c(c2)C(F)(F)F)ccc1C Show InChI InChI=1S/C33H30F3N7O3/c1-6-28(44)40-26-14-23(11-8-19(26)3)39-31-37-16-22-17-43(32(46)42(5)29(22)41-31)27-15-24(12-9-20(27)4)38-30(45)21-10-7-18(2)25(13-21)33(34,35)36/h6-16H,1,17H2,2-5H3,(H,38,45)(H,40,44)(H,37,39,41)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236086 (CHEMBL4068296) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2ccc3OCOc3c2)ccc1C Show InChI InChI=1S/C31H29N7O5/c1-5-27(39)36-23-14-21(10-7-17(23)2)35-31-33-15-22(28(32-4)38-31)30(41)37-24-13-20(9-6-18(24)3)34-29(40)19-8-11-25-26(12-19)43-16-42-25/h5-15H,1,16H2,2-4H3,(H,34,40)(H,36,39)(H,37,41)(H2,32,33,35,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibitory activity against radioligand [3H]nisoxetine binding at the norepinephrine transporter				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236074 (CHEMBL4078199) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)[C@H]2CC[C@@H](CC2)C(F)(F)F)ccc1C |r,wU:31.33,wD:34.40,(73.75,-22.65,;73.76,-21.11,;75.1,-20.34,;76.44,-21.11,;75.1,-18.8,;73.77,-18.02,;72.45,-18.79,;71.13,-18.01,;69.79,-18.77,;69.78,-20.31,;68.44,-21.08,;68.43,-22.62,;67.08,-23.37,;67.07,-24.91,;68.41,-25.7,;68.4,-27.24,;69.75,-24.92,;71.09,-25.7,;72.43,-24.92,;72.43,-23.38,;73.75,-25.7,;73.73,-27.24,;69.76,-23.38,;71.1,-21.09,;72.43,-20.33,;76.43,-18.03,;77.77,-18.8,;79.11,-18.03,;80.45,-18.8,;81.78,-18.03,;81.78,-16.49,;83.11,-18.79,;84.43,-18.02,;85.76,-18.79,;85.76,-20.33,;84.43,-21.09,;83.11,-20.33,;87.09,-21.1,;88.42,-20.33,;87.08,-22.63,;88.41,-21.86,;79.1,-16.48,;77.77,-15.71,;76.43,-16.49,;75.1,-15.71,)| Show InChI InChI=1S/C32H34F3N7O3/c1-5-27(43)39-25-14-23(12-6-18(25)2)38-30-36-16-21-17-42(31(45)41(4)28(21)40-30)26-15-24(13-7-19(26)3)37-29(44)20-8-10-22(11-9-20)32(33,34)35/h5-7,12-16,20,22H,1,8-11,17H2,2-4H3,(H,37,44)(H,39,43)(H,36,38,40)/t20-,22-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.82E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236084 (CHEMBL4101569) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2ccccc2OC)ccc1C Show InChI InChI=1S/C31H31N7O4/c1-6-27(39)36-24-16-21(14-12-18(24)2)35-31-33-17-23(28(32-4)38-31)30(41)37-25-15-20(13-11-19(25)3)34-29(40)22-9-7-8-10-26(22)42-5/h6-17H,1H2,2-5H3,(H,34,40)(H,36,39)(H,37,41)(H2,32,33,35,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.88E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory constant against CD45				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236081 (CHEMBL4065343) Show SMILES CCC[C@H]1CC[C@@H](CC1)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O |r,wU:6.9,wD:3.2,(44.68,-21.85,;43.35,-21.07,;42.02,-21.84,;40.69,-21.07,;40.69,-19.53,;39.36,-18.76,;38.04,-19.54,;38.04,-21.07,;39.36,-21.83,;36.71,-18.77,;36.71,-17.23,;35.37,-19.54,;34.04,-18.77,;34.03,-17.22,;32.69,-16.45,;31.36,-17.23,;30.02,-16.45,;31.36,-18.77,;32.69,-19.54,;30.02,-19.54,;28.69,-18.76,;27.37,-19.53,;26.05,-18.75,;24.71,-19.51,;24.7,-21.05,;23.36,-21.82,;23.35,-23.36,;22,-24.11,;21.99,-25.66,;23.33,-26.44,;23.32,-27.98,;24.67,-25.66,;26.01,-26.44,;27.35,-25.67,;27.35,-24.13,;28.68,-26.45,;28.66,-27.99,;24.68,-24.12,;26.02,-21.83,;27.35,-21.07,;28.68,-21.85,;28.68,-23.39,;30.03,-21.08,;31.37,-21.85,)| Show InChI InChI=1S/C34H41N7O3/c1-6-8-23-11-13-24(14-12-23)32(43)36-27-16-10-22(4)29(18-27)41-20-25-19-35-33(39-31(25)40(5)34(41)44)37-26-15-9-21(3)28(17-26)38-30(42)7-2/h7,9-10,15-19,23-24H,2,6,8,11-14,20H2,1,3-5H3,(H,36,43)(H,38,42)(H,35,37,39)/t23-,24-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Agonist activity was determined against hPR (human progesterone receptor) compared to that of progesterone (100%)				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236069 (CHEMBL4086091) Show SMILES CCCC[C@H]1CC[C@@H](CC1)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O |r,wU:7.10,wD:4.3,(45.47,-34.26,;44.14,-35.03,;42.81,-34.25,;41.48,-35.02,;40.16,-34.25,;40.16,-32.71,;38.83,-31.94,;37.51,-32.72,;37.5,-34.25,;38.82,-35.01,;36.17,-31.95,;36.17,-30.41,;34.84,-32.72,;33.5,-31.95,;33.49,-30.4,;32.16,-29.63,;30.82,-30.41,;29.49,-29.63,;30.82,-31.95,;32.16,-32.72,;29.48,-32.72,;28.15,-31.94,;26.83,-32.71,;25.51,-31.93,;24.17,-32.69,;24.16,-34.23,;22.82,-35,;22.81,-36.54,;21.47,-37.29,;21.46,-38.84,;22.79,-39.62,;22.79,-41.16,;24.14,-38.84,;25.47,-39.62,;26.81,-38.85,;26.82,-37.31,;28.14,-39.63,;28.12,-41.17,;24.14,-37.3,;25.49,-35.01,;26.82,-34.25,;28.15,-35.03,;28.14,-36.57,;29.49,-34.26,;30.83,-35.03,)| Show InChI InChI=1S/C35H43N7O3/c1-6-8-9-24-12-14-25(15-13-24)33(44)37-28-17-11-23(4)30(19-28)42-21-26-20-36-34(40-32(26)41(5)35(42)45)38-27-16-10-22(3)29(18-27)39-31(43)7-2/h7,10-11,16-20,24-25H,2,6,8-9,12-15,21H2,1,3-5H3,(H,37,44)(H,39,43)(H,36,38,40)/t24-,25-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236079 (CHEMBL4071822) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)[C@@H](N)CCC(=O)OC(C)(C)C)ccc1C |r| Show InChI InChI=1S/C33H40N8O5/c1-8-27(42)38-25-15-22(11-9-19(25)2)37-31-35-17-21-18-41(32(45)40(7)29(21)39-31)26-16-23(12-10-20(26)3)36-30(44)24(34)13-14-28(43)46-33(4,5)6/h8-12,15-17,24H,1,13-14,18,34H2,2-7H3,(H,36,44)(H,38,42)(H,35,37,39)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236040 (CHEMBL4097888) Show SMILES CN(C)c1ccc(cc1)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O Show InChI InChI=1S/C33H34N8O3/c1-7-29(42)37-27-16-24(12-8-20(27)2)36-32-34-18-23-19-41(33(44)40(6)30(23)38-32)28-17-25(13-9-21(28)3)35-31(43)22-10-14-26(15-11-22)39(4)5/h7-18H,1,19H2,2-6H3,(H,35,43)(H,37,42)(H,34,36,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236046 (CHEMBL4102474) Show SMILES C[C@H]1CC[C@@H](CC1)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O |r,wU:4.7,wD:1.0,(19.76,-34.99,;18.43,-34.22,;18.43,-32.68,;17.1,-31.91,;15.78,-32.68,;15.78,-34.22,;17.1,-34.98,;14.45,-31.92,;14.45,-30.38,;13.12,-32.69,;11.78,-31.92,;11.78,-30.37,;10.44,-29.6,;9.11,-30.38,;7.77,-29.61,;9.1,-31.93,;10.44,-32.69,;7.77,-32.69,;6.44,-31.91,;5.12,-32.68,;3.8,-31.9,;2.46,-32.66,;2.45,-34.2,;1.11,-34.97,;1.1,-36.51,;-.25,-37.26,;-.26,-38.8,;1.08,-39.58,;1.08,-41.12,;2.43,-38.81,;3.76,-39.58,;5.1,-38.81,;5.1,-37.27,;6.43,-39.59,;6.41,-41.13,;2.43,-37.27,;3.78,-34.97,;5.11,-34.22,;6.43,-35,;6.43,-36.54,;7.78,-34.23,;9.11,-35,)| Show InChI InChI=1S/C32H37N7O3/c1-6-28(40)36-26-15-24(13-9-20(26)3)35-31-33-17-23-18-39(32(42)38(5)29(23)37-31)27-16-25(14-10-21(27)4)34-30(41)22-11-7-19(2)8-12-22/h6,9-10,13-17,19,22H,1,7-8,11-12,18H2,2-5H3,(H,34,41)(H,36,40)(H,33,35,37)/t19-,22-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM50236033 (CHEMBL4087478) Show SMILES CCC(=O)Nc1cc(Nc2ncc(C(=O)Nc3cc(NC(=O)c4cc(OC)c(OC)c(OC)c4)ccc3C)c(NC)n2)ccc1C Show InChI InChI=1S/C33H37N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h9-17H,8H2,1-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Compound was evaluated for 50% inhibition of PTP1B using uM)				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236070 (CHEMBL4060425) Show SMILES CN1C(=O)N(Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc12)c1cc(NC(=O)[C@@H](N)Cc2ccccc2)ccc1C |r| Show InChI InChI=1S/C33H34N8O3/c1-5-29(42)38-27-16-24(13-11-20(27)2)37-32-35-18-23-19-41(33(44)40(4)30(23)39-32)28-17-25(14-12-21(28)3)36-31(43)26(34)15-22-9-7-6-8-10-22/h5-14,16-18,26H,1,15,19,34H2,2-4H3,(H,36,43)(H,38,42)(H,35,37,39)/t26-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibitory activity against radioligand [3H]paroxetine binding at the serotonin transporter				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236045 (CHEMBL4086774) Show SMILES CC(C)[C@H]1CC[C@@H](CC1)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O |r,wU:6.9,wD:3.2,(66.11,-20.74,;64.78,-21.51,;64.78,-23.04,;63.45,-20.74,;63.46,-19.2,;62.12,-18.42,;60.8,-19.2,;60.8,-20.73,;62.12,-21.5,;59.47,-18.44,;59.47,-16.89,;58.14,-19.21,;56.8,-18.44,;56.79,-16.89,;55.45,-16.12,;54.12,-16.89,;52.78,-16.12,;54.12,-18.44,;55.46,-19.21,;52.78,-19.21,;51.45,-18.43,;50.13,-19.2,;48.81,-18.42,;47.47,-19.17,;47.46,-20.72,;46.12,-21.49,;46.11,-23.03,;44.77,-23.78,;44.76,-25.32,;46.09,-26.11,;46.08,-27.65,;47.44,-25.33,;48.77,-26.11,;50.11,-25.33,;50.11,-23.79,;51.44,-26.11,;51.42,-27.65,;47.44,-23.79,;48.79,-21.49,;50.12,-20.73,;51.45,-21.51,;51.44,-23.06,;52.79,-20.74,;54.13,-21.52,)| Show InChI InChI=1S/C34H41N7O3/c1-7-30(42)38-28-16-26(14-8-21(28)4)37-33-35-18-25-19-41(34(44)40(6)31(25)39-33)29-17-27(15-9-22(29)5)36-32(43)24-12-10-23(11-13-24)20(2)3/h7-9,14-18,20,23-24H,1,10-13,19H2,2-6H3,(H,36,43)(H,38,42)(H,35,37,39)/t23-,24-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236034 (CHEMBL4095791) Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1ccc(C)c(c1)N1Cc2cnc(Nc3ccc(C)c(NC(=O)C=C)c3)nc2N(C)C1=O Show InChI InChI=1S/C34H35N7O6/c1-8-29(42)38-25-15-23(11-9-19(25)2)37-33-35-17-22-18-41(34(44)40(4)31(22)39-33)26-16-24(12-10-20(26)3)36-32(43)21-13-27(45-5)30(47-7)28(14-21)46-6/h8-17H,1,18H2,2-7H3,(H,36,43)(H,38,42)(H,35,37,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236082 (CHEMBL4089476) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2ccc(OC)c(OC)c2)ccc1C Show InChI InChI=1S/C32H33N7O5/c1-7-28(40)37-24-16-22(12-9-18(24)2)36-32-34-17-23(29(33-4)39-32)31(42)38-25-15-21(11-8-19(25)3)35-30(41)20-10-13-26(43-5)27(14-20)44-6/h7-17H,1H2,2-6H3,(H,35,41)(H,37,40)(H,38,42)(H2,33,34,36,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Agonist activity was determined against hPR (human progesterone receptor) compared to that of progesterone (100%)				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236044 (CHEMBL4066104) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C Show InChI InChI=1S/C33H35N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h8-17H,1H2,2-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Binding affinity to inactive state of full length fluorescent labeled human BMX (1 to 675 amino acid residues) expressed in bacterial expression syst...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236044 (CHEMBL4066104) Show SMILES CNc1nc(Nc2ccc(C)c(NC(=O)C=C)c2)ncc1C(=O)Nc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C Show InChI InChI=1S/C33H35N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h8-17H,1H2,2-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	5.80	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Irreversible inhibition of inactive state of wild-type full-length recombinant His-tagged BMX phosphorylation (unknown origin) at tyrosine residue ex...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236033 (CHEMBL4087478) Show SMILES CCC(=O)Nc1cc(Nc2ncc(C(=O)Nc3cc(NC(=O)c4cc(OC)c(OC)c(OC)c4)ccc3C)c(NC)n2)ccc1C Show InChI InChI=1S/C33H37N7O6/c1-8-28(41)38-24-16-22(12-10-18(24)2)37-33-35-17-23(30(34-4)40-33)32(43)39-25-15-21(11-9-19(25)3)36-31(42)20-13-26(44-5)29(46-7)27(14-20)45-6/h9-17H,8H2,1-7H3,(H,36,42)(H,38,41)(H,39,43)(H2,34,35,37,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	197	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Irreversible inhibition of inactive state of wild-type full-length recombinant His-tagged BMX phosphorylation (unknown origin) at tyrosine residue ex...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair

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