Compile Data Set for Download or QSAR

Found 118 hits Enz. Inhib. hit(s) with all data for entry = 8753   

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
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390012 (4-amino-1-[(3R)-1-[(E)-4- (dimethylamino)but-2-eno...) Show SMILES CN(C)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C29H32N6O3/c1-33(2)16-7-11-25(36)34-17-6-8-21(18-34)35-19-24(26-27(35)29(37)32-31-28(26)30)20-12-14-23(15-13-20)38-22-9-4-3-5-10-22/h3-5,7,9-15,19,21H,6,8,16-18H2,1-2H3,(H2,30,31)(H,32,37)/b11-7+/t21-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390001 (US10323037, Example 18 | US9951077, 18) Show SMILES CNC\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C28H30N6O3/c1-30-15-5-10-24(35)33-16-6-7-20(17-33)34-18-23(25-26(34)28(36)32-31-27(25)29)19-11-13-22(14-12-19)37-21-8-3-2-4-9-21/h2-5,8-14,18,20,30H,6-7,15-17H2,1H3,(H2,29,31)(H,32,36)/b10-5+/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390014 (4-amino-1-[(3R)-1-[(E)-4- (cyclopropylamino)but-2-...) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)\C=C\CNC1CC1 Show InChI InChI=1S/C30H32N6O3/c31-29-27-25(20-10-14-24(15-11-20)39-23-7-2-1-3-8-23)19-36(28(27)30(38)34-33-29)22-6-5-17-35(18-22)26(37)9-4-16-32-21-12-13-21/h1-4,7-11,14-15,19,21-22,32H,5-6,12-13,16-18H2,(H2,31,33)(H,34,38)/b9-4+/t22-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390018 (4-amino-1-[(3R)-1-[(E)-4- [cyclobutyl(methyl)amino...) Show SMILES CN(C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12)C1CCC1 Show InChI InChI=1S/C32H36N6O3/c1-36(23-8-5-9-23)18-7-13-28(39)37-19-6-10-24(20-37)38-21-27(29-30(38)32(40)35-34-31(29)33)22-14-16-26(17-15-22)41-25-11-3-2-4-12-25/h2-4,7,11-17,21,23-24H,5-6,8-10,18-20H2,1H3,(H2,33,34)(H,35,40)/b13-7+/t24-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390020 (4-amino-1-[(3R)-1-[(E)-4-(azetidin- 1-yl)but-2-eno...) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)\C=C\CN1CCC1 Show InChI InChI=1S/C30H32N6O3/c31-29-27-25(21-11-13-24(14-12-21)39-23-8-2-1-3-9-23)20-36(28(27)30(38)33-32-29)22-7-4-18-35(19-22)26(37)10-5-15-34-16-6-17-34/h1-3,5,8-14,20,22H,4,6-7,15-19H2,(H2,31,32)(H,33,38)/b10-5+/t22-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390021 (4-amino-3-(4-phenoxyphenyl)-1- [(3R)-1-[(E)-4-pyrr...) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)\C=C\CN1CCCC1 Show InChI InChI=1S/C31H34N6O3/c32-30-28-26(22-12-14-25(15-13-22)40-24-9-2-1-3-10-24)21-37(29(28)31(39)34-33-30)23-8-6-19-36(20-23)27(38)11-7-18-35-16-4-5-17-35/h1-3,7,9-15,21,23H,4-6,8,16-20H2,(H2,32,33)(H,34,39)/b11-7+/t23-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390022 (4-amino-1-[(3R)-1-[(E)-4- morpholinobut-2-enoyl]-3...) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)\C=C\CN1CCOCC1 Show InChI InChI=1S/C31H34N6O4/c32-30-28-26(22-10-12-25(13-11-22)41-24-7-2-1-3-8-24)21-37(29(28)31(39)34-33-30)23-6-4-15-36(20-23)27(38)9-5-14-35-16-18-40-19-17-35/h1-3,5,7-13,21,23H,4,6,14-20H2,(H2,32,33)(H,34,39)/b9-5+/t23-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390023 (4-amino-1-[(3R)-1-[(E)-4-(4- methylpiperazin-1-yl)...) Show SMILES CN1CCN(C\C=C\C(=O)N2CCC[C@H](C2)n2cc(-c3ccc(Oc4ccccc4)cc3)c3c(N)n[nH]c(=O)c23)CC1 Show InChI InChI=1S/C32H37N7O3/c1-36-17-19-37(20-18-36)15-6-10-28(40)38-16-5-7-24(21-38)39-22-27(29-30(39)32(41)35-34-31(29)33)23-11-13-26(14-12-23)42-25-8-3-2-4-9-25/h2-4,6,8-14,22,24H,5,7,15-21H2,1H3,(H2,33,34)(H,35,41)/b10-6+/t24-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390025 (4-amino-1-[1-[(E)-4- (dimethylamino)but-2-enoyl]-3...) Show SMILES CN(C)C\C=C\C(=O)N1CCCC(C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390026 (4-amino-1-[(3R)-1-[(E)-4- (dimethylamino)but-2- en...) Show SMILES CN(C)C\C=C\C(=O)N1CC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C28H30N6O3/c1-32(2)15-6-9-24(35)33-16-14-20(17-33)34-18-23(25-26(34)28(36)31-30-27(25)29)19-10-12-22(13-11-19)37-21-7-4-3-5-8-21/h3-13,18,20H,14-17H2,1-2H3,(H2,29,30)(H,31,36)/b9-6+/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390032 (4-amino-1-[1-[(E)-4- (dimethylamino)but-2-enoyl]-4...) Show SMILES CN(C)C\C=C\C(=O)N1CCC(F)C(C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390034 (4-amino-1-[[1-[(E)-4- (dimethylamino)but-2- enoyl]...) Show SMILES CN(C)C\C=C\C(=O)N1CC(Cn2cc(-c3ccc(Oc4ccccc4)cc3)c3c(N)n[nH]c(=O)c23)C1 Show InChI InChI=1S/C28H30N6O3/c1-32(2)14-6-9-24(35)33-15-19(16-33)17-34-18-23(25-26(34)28(36)31-30-27(25)29)20-10-12-22(13-11-20)37-21-7-4-3-5-8-21/h3-13,18-19H,14-17H2,1-2H3,(H2,29,30)(H,31,36)/b9-6+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390038 (US10323037, Example 51 | US9951077, 51) Show SMILES COc1ccc(cc1)-c1cn(C2CCCN(C2)C(=O)C=C)c2c1c(N)n[nH]c2=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390039 (US10323037, Example 52 | US9951077, 52) Show SMILES COc1ccc(cc1)-c1cn(C2CCCN(C2)C(=O)\C=C\CN(C)C)c2c1c(N)n[nH]c2=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390040 (US10323037, Example 53 | US9951077, 53) Show SMILES COc1ccc(cc1Cl)-c1cn(C2CCCN(C2)C(=O)C=C)c2c1c(N)n[nH]c2=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390041 (US10323037, Example 54 | US9951077, 54) Show SMILES COc1ccc(cc1Cl)-c1cn(C2CCCN(C2)C(=O)\C=C\CN(C)C)c2c1c(N)n[nH]c2=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390042 (US10323037, Example 55 | US9951077, 55) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4F)cc3)c12)C1CCCN(C1)C(=O)C=C Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390043 (US10323037, Example 56 | US9951077, 56) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4F)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C Show InChI InChI=1S/C26H24FN5O3/c1-2-22(33)31-13-5-6-17(14-31)32-15-19(23-24(32)26(34)30-29-25(23)28)16-9-11-18(12-10-16)35-21-8-4-3-7-20(21)27/h2-4,7-12,15,17H,1,5-6,13-14H2,(H2,28,29)(H,30,34)/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390044 (US10323037, Example 57 | US9951077, 57) Show SMILES CN(C)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3F)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C29H31FN6O3/c1-34(2)15-6-10-25(37)35-16-5-7-20(17-35)36-18-22(26-27(36)29(38)33-32-28(26)31)19-11-13-21(14-12-19)39-24-9-4-3-8-23(24)30/h3-4,6,8-14,18,20H,5,7,15-17H2,1-2H3,(H2,31,32)(H,33,38)/b10-6+/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM416771 ((R)-1-(1-acryloylpiperidin-3-yl)-4-amino-3-(4-(2,6...) Show SMILES CC(C)(C)OC(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3c(F)cccc3F)cc2)c2c(N)n[nH]c(=O)c12 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390050 (US10323037, Example 63 | US9951077, 63) Show SMILES CN(C)C\C=C\C(=O)N1CCCC(C1)n1cc(-c2ccc(Oc3cccc(F)c3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390054 (US10323037, Example 67 | US9951077, 67) Show SMILES CN(C)C\C=C\C(=O)N1CCCC(C1)n1cc(-c2ccc(Oc3cccc(Cl)c3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390056 (US10323037, Example 69 | US9951077, 69) Show SMILES COc1cc(ccc1Oc1cccc(Cl)c1)-c1cn(C2CCCN(C2)C(=O)\C=C\CN(C)C)c2c1c(N)n[nH]c2=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390058 (US10323037, Example 71 | US9951077, 71) Show SMILES CN(C)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3Cl)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C29H31ClN6O3/c1-34(2)15-6-10-25(37)35-16-5-7-20(17-35)36-18-22(26-27(36)29(38)33-32-28(26)31)19-11-13-21(14-12-19)39-24-9-4-3-8-23(24)30/h3-4,6,8-14,18,20H,5,7,15-17H2,1-2H3,(H2,31,32)(H,33,38)/b10-6+/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390062 (US10323037, Example 75 | US9951077, 75) Show SMILES CN(C)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)c(F)c2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C29H31FN6O3/c1-34(2)14-7-11-25(37)35-15-6-8-20(17-35)36-18-22(26-27(36)29(38)33-32-28(26)31)19-12-13-24(23(30)16-19)39-21-9-4-3-5-10-21/h3-5,7,9-13,16,18,20H,6,8,14-15,17H2,1-2H3,(H2,31,32)(H,33,38)/b11-7+/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390064 (US10323037, Example 77 | US9951077, 77) Show SMILES CN(C)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2F)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C29H31FN6O3/c1-34(2)14-7-11-25(37)35-15-6-8-19(17-35)36-18-23(26-27(36)29(38)33-32-28(26)31)22-13-12-21(16-24(22)30)39-20-9-4-3-5-10-20/h3-5,7,9-13,16,18-19H,6,8,14-15,17H2,1-2H3,(H2,31,32)(H,33,38)/b11-7+/t19-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390065 (US10323037, Example 78 | US9951077, 78) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4c(F)cccc4Cl)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C Show InChI InChI=1S/C26H23ClFN5O3/c1-2-21(34)32-12-4-5-16(13-32)33-14-18(22-23(33)26(35)31-30-25(22)29)15-8-10-17(11-9-15)36-24-19(27)6-3-7-20(24)28/h2-3,6-11,14,16H,1,4-5,12-13H2,(H2,29,30)(H,31,35)/t16-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390066 (US10323037, Example 79 | US9951077, 79) Show SMILES CN(C)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3c(F)cccc3Cl)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C29H30ClFN6O3/c1-35(2)14-5-9-24(38)36-15-4-6-19(16-36)37-17-21(25-26(37)29(39)34-33-28(25)32)18-10-12-20(13-11-18)40-27-22(30)7-3-8-23(27)31/h3,5,7-13,17,19H,4,6,14-16H2,1-2H3,(H2,32,33)(H,34,39)/b9-5+/t19-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390069 (US10323037, Example 82 | US9951077, 82) Show SMILES CN(C)C\C=C\C(=O)N1CCC[C@H](C1)n1c(F)c(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C29H31FN6O3/c1-34(2)16-7-11-23(37)35-17-6-8-20(18-35)36-26-25(28(31)32-33-29(26)38)24(27(36)30)19-12-14-22(15-13-19)39-21-9-4-3-5-10-21/h3-5,7,9-15,20H,6,8,16-18H2,1-2H3,(H2,31,32)(H,33,38)/b11-7+/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390074 (US10323037, Example 87 | US9951077, 87) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4F)cc3)c12)[C@@H]1CCCN(C1)C#N Show InChI InChI=1S/C24H21FN6O2/c25-19-5-1-2-6-20(19)33-17-9-7-15(8-10-17)18-13-31(16-4-3-11-30(12-16)14-26)22-21(18)23(27)28-29-24(22)32/h1-2,5-10,13,16H,3-4,11-12H2,(H2,27,28)(H,29,32)/t16-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM416801 (N-(3-(4-amino-7-oxo-3-(4-phenoxyphenyl)-6,7-dihydr...) Show SMILES CCc1c(C#N)c(cn1-c1cccc(NC(=O)OC(C)(C)C)c1)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C30H29N3O3/c1-5-28-26(19-31)27(21-14-16-25(17-15-21)35-24-12-7-6-8-13-24)20-33(28)23-11-9-10-22(18-23)32-29(34)36-30(2,3)4/h6-18,20H,5H2,1-4H3,(H,32,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390087 (US10323037, Example 99 | US9951077, 99) Show SMILES CN(C)CC#CC(=O)N1CC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3F)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C28H27FN6O3/c1-33(2)14-5-8-24(36)34-15-13-19(16-34)35-17-21(25-26(35)28(37)32-31-27(25)30)18-9-11-20(12-10-18)38-23-7-4-3-6-22(23)29/h3-4,6-7,9-12,17,19H,13-16H2,1-2H3,(H2,30,31)(H,32,37)/t19-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390095 (US10323037, Example 107 | US9951077, 107) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCN(C1)C#N Show InChI InChI=1S/C23H20N6O2/c24-14-28-11-10-16(12-28)29-13-19(20-21(29)23(30)27-26-22(20)25)15-6-8-18(9-7-15)31-17-4-2-1-3-5-17/h1-9,13,16H,10-12H2,(H2,25,26)(H,27,30)/t16-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390096 (US10323037, Example 108 | US9951077, 108) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4F)cc3)c12)C1CCCN(C1)C#N Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM416824 ((R)-4-amino-1-(1-(but-2-ynoyl)pyrrolidin-3-yl)-3-(...) Show SMILES CC#CC(=O)N1CCC(C1)n1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM416714 ((R)-1-(1-acryloylpiperidin-3-yl)-4-amino-3-(4-phen...) Show SMILES CCc1c(C#N)c(cn1[C@@H]1CCCN(C1)C(=O)OC(C)(C)C)-c1ccc(Oc2ccccc2)cc1 |r| Show InChI InChI=1S/C29H33N3O3/c1-5-27-25(18-30)26(21-13-15-24(16-14-21)34-23-11-7-6-8-12-23)20-32(27)22-10-9-17-31(19-22)28(33)35-29(2,3)4/h6-8,11-16,20,22H,5,9-10,17,19H2,1-4H3/t22-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM416715 (4-amino-3-(4-phenoxyphenyl)-1-(1- prop-2-enoyl-3-p...) Show SMILES Nc1n[nH]c(=O)c2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCN(C1)C(=O)C=C Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM416726 (1-(1-acryloyl-4-fluoropiperidin-3-yl)-4-amino-3-(4...) Show SMILES CCc1c(C#N)c(cn1C1CN(CCC1F)C(=O)OCc1ccccc1)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C32H30FN3O3/c1-2-30-27(19-34)28(24-13-15-26(16-14-24)39-25-11-7-4-8-12-25)20-36(30)31-21-35(18-17-29(31)33)32(37)38-22-23-9-5-3-6-10-23/h3-16,20,29,31H,2,17-18,21-22H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM416727 ((R)-1-(1-acryloyl-5,5-difluoropiperidin-3-yl)-4-am...) Show SMILES CCc1c(C#N)c(cn1[C@H]1CN(CC(F)(F)C1)C(=O)OC(C)(C)C)-c1ccc(Oc2ccccc2)cc1 |r| Show InChI InChI=1S/C29H31F2N3O3/c1-5-26-24(16-32)25(20-11-13-23(14-12-20)36-22-9-7-6-8-10-22)18-34(26)21-15-29(30,31)19-33(17-21)27(35)37-28(2,3)4/h6-14,18,21H,5,15,17,19H2,1-4H3/t21-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM389999 (US10323037, Example 16 | US9951077, 16) Show SMILES CC(C)N(C)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C31H36N6O3/c1-21(2)35(3)17-8-12-27(38)36-18-7-9-23(19-36)37-20-26(28-29(37)31(39)34-33-30(28)32)22-13-15-25(16-14-22)40-24-10-5-4-6-11-24/h4-6,8,10-16,20-21,23H,7,9,17-19H2,1-3H3,(H2,32,33)(H,34,39)/b12-8+/t23-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390013 (4-amino-1-[(3R)-1-[(E)-4- (diethylamino)but-2-enoy...) Show SMILES CCN(CC)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C31H36N6O3/c1-3-35(4-2)18-9-13-27(38)36-19-8-10-23(20-36)37-21-26(28-29(37)31(39)34-33-30(28)32)22-14-16-25(17-15-22)40-24-11-6-5-7-12-24/h5-7,9,11-17,21,23H,3-4,8,10,18-20H2,1-2H3,(H2,32,33)(H,34,39)/b13-9+/t23-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390005 (4-amino-1-[(3R)-1-(2-chloroacetyl)- 3-piperidyl]-3...) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)CCl Show InChI InChI=1S/C25H24ClN5O3/c26-13-21(32)30-12-4-5-17(14-30)31-15-20(22-23(31)25(33)29-28-24(22)27)16-8-10-19(11-9-16)34-18-6-2-1-3-7-18/h1-3,6-11,15,17H,4-5,12-14H2,(H2,27,28)(H,29,33)/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390006 (4-amino-1-[(3R)-1- (cyclopropanecarbonyl)-3- piper...) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C1CC1 Show InChI InChI=1S/C27H27N5O3/c28-25-23-22(17-10-12-21(13-11-17)35-20-6-2-1-3-7-20)16-32(24(23)26(33)30-29-25)19-5-4-14-31(15-19)27(34)18-8-9-18/h1-3,6-7,10-13,16,18-19H,4-5,8-9,14-15H2,(H2,28,29)(H,30,33)/t19-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390007 (3-[(3R)-3-[4-amino-7-oxo-3-(4- phenoxyphenyl)-6H-p...) Show SMILES Nc1n[nH]c(=O)c2n(cc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)CC#N Show InChI InChI=1S/C26H24N6O3/c27-13-12-22(33)31-14-4-5-18(15-31)32-16-21(23-24(32)26(34)30-29-25(23)28)17-8-10-20(11-9-17)35-19-6-2-1-3-7-19/h1-3,6-11,16,18H,4-5,12,14-15H2,(H2,28,29)(H,30,34)/t18-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390008 (4-amino-1-[(3R)-1-[(E)-but-2- enoyl]-3-piperidyl]-...) Show SMILES C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C27H27N5O3/c1-2-7-23(33)31-15-6-8-19(16-31)32-17-22(24-25(32)27(34)30-29-26(24)28)18-11-13-21(14-12-18)35-20-9-4-3-5-10-20/h2-5,7,9-14,17,19H,6,8,15-16H2,1H3,(H2,28,29)(H,30,34)/b7-2+/t19-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390016 (4-amino-1-[(3R)-1-[(E)-4- (cyclopropyl(methyl)amin...) Show SMILES CN(C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12)C1CC1 Show InChI InChI=1S/C31H34N6O3/c1-35(22-13-14-22)17-6-10-27(38)36-18-5-7-23(19-36)37-20-26(28-29(37)31(39)34-33-30(28)32)21-11-15-25(16-12-21)40-24-8-3-2-4-9-24/h2-4,6,8-12,15-16,20,22-23H,5,7,13-14,17-19H2,1H3,(H2,32,33)(H,34,39)/b10-6+/t23-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390017 (4-amino-1-[(3R)-1-[(E)-4- [cyclopropyl(ethyl)amino...) Show SMILES CCN(C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12)C1CC1 Show InChI InChI=1S/C32H36N6O3/c1-2-36(23-14-15-23)18-7-11-28(39)37-19-6-8-24(20-37)38-21-27(29-30(38)32(40)35-34-31(29)33)22-12-16-26(17-13-22)41-25-9-4-3-5-10-25/h3-5,7,9-13,16-17,21,23-24H,2,6,8,14-15,18-20H2,1H3,(H2,33,34)(H,35,40)/b11-7+/t24-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390019 (4-amino-1-[(3R)-1-[(E)-4- [cyclohexyl(methyl)amino...) Show SMILES CN(C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12)C1CCCCC1 Show InChI InChI=1S/C34H40N6O3/c1-38(25-10-4-2-5-11-25)20-9-15-30(41)39-21-8-12-26(22-39)40-23-29(31-32(40)34(42)37-36-33(31)35)24-16-18-28(19-17-24)43-27-13-6-3-7-14-27/h3,6-7,9,13-19,23,25-26H,2,4-5,8,10-12,20-22H2,1H3,(H2,35,36)(H,37,42)/b15-9+/t26-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390027 (4-amino-1-[1-[(E)-4- (dimethylamino)but-2- enoyl]a...) Show SMILES CN(C)C\C=C\C(=O)N1CC(C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C27H28N6O3/c1-31(2)14-6-9-23(34)32-15-19(16-32)33-17-22(24-25(33)27(35)30-29-26(24)28)18-10-12-21(13-11-18)36-20-7-4-3-5-8-20/h3-13,17,19H,14-16H2,1-2H3,(H2,28,29)(H,30,35)/b9-6+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390028 (4-amino-1-[[(2S)-1-[(E)-4- (dimethylamino)but-2- e...) Show SMILES CN(C)C\C=C\C(=O)N1CCC[C@H]1Cn1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C29H32N6O3/c1-33(2)16-7-11-25(36)35-17-6-8-21(35)18-34-19-24(26-27(34)29(37)32-31-28(26)30)20-12-14-23(15-13-20)38-22-9-4-3-5-10-22/h3-5,7,9-15,19,21H,6,8,16-18H2,1-2H3,(H2,30,31)(H,32,37)/b11-7+/t21-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair

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