Compile Data Set for Download or QSAR

Found 740 hits of ic50 data for polymerid = 7571   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549671 (CHEMBL4760558) Show SMILES CS(=O)(=O)Nc1cc(cc(c1)-c1c[nH]c2ncc(cc12)-c1cccc(c1)C(=O)NC1CC1)C#N Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.120	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549681 (CHEMBL4749291) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4cc(NS(C)(=O)=O)cc(c4)C#N)c3c2)CC1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.130	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549672 (CHEMBL4762464) Show SMILES CNC(=O)c1cccc(c1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)cc(c3)C#N)c2c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.180	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549680 (CHEMBL4759123) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4cc(NS(=O)(=O)C5CC5)cc(c4)C#N)c3c2)CC1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.190	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549670 (CHEMBL4744045) Show SMILES CS(=O)(=O)Nc1cc(cc(c1)-c1c[nH]c2ncc(cc12)-c1cccc(c1)C(=O)N1CCCC1)C#N Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.210	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549674 (CHEMBL4751494) Show SMILES CN1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)cc(c3)C#N)c2c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.210	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549668 (CHEMBL4788405) Show SMILES CS(=O)(=O)Nc1cc(cc(c1)-c1c[nH]c2ncc(cc12)-c1cccc(c1)C(=O)N1CCCCC1)C#N Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.220	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549669 (CHEMBL4788976) Show SMILES CN(C)C1CCN(C1)C(=O)c1cccc(c1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)cc(c3)C#N)c2c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.220	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549675 (CHEMBL4797452) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4cc(C#N)c5[nH]ncc5c4)c3c2)CC1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549673 (CHEMBL4791330) Show SMILES CN1CCN(CC1)C(=O)c1cccc(c1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)cc(c3)C#N)c2c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.25	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549664 (CHEMBL4756005) Show SMILES CNC(=O)c1cccc(c1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)c(Cl)c(c3)C#N)c2c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM2579 ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...) Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	0.314	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human TNIK using RLGRDKYKTLRQIRQ as substrate by [gamma-33P]-ATP assay				Citation and Details Article DOI: 10.1016/j.bmc.2018.02.022 BindingDB Entry DOI: 10.7270/Q2DJ5KB8
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549666 (CHEMBL4788688) Show SMILES CC(C)(Oc1ccc(cc1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)cc(c3)C#N)c2c1)C(O)=O Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.330	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549679 (CHEMBL4760435) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4cc(NS(C)(=O)=O)c(Cl)c(c4)C#N)c3c2)CC1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.430	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM420217 (US10485800, Cmpd ID FS | US10485800, Example 173) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4ccc5[nH]ncc5c4)c3c2)CC1 Show InChI InChI=1S/C26H26N6/c1-31-8-10-32(11-9-31)17-18-2-4-19(5-3-18)21-13-23-24(16-28-26(23)27-14-21)20-6-7-25-22(12-20)15-29-30-25/h2-7,12-16H,8-11,17H2,1H3,(H,27,28)(H,29,30)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	UniChem	Article PubMed	n/a	n/a	0.440	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549667 (CHEMBL4797770) Show SMILES CC(C)(C(O)=O)c1ccc(cc1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)cc(c3)C#N)c2c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.470	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM2579 ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...) Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	0.551	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Inhibition of human TNIK using RLGRDKYKTLRQIRQ as substrate by [gamma-33P]-ATP assay				Eur J Med Chem 161: 456-467 (2019) Article DOI: 10.1016/j.ejmech.2018.10.052 BindingDB Entry DOI: 10.7270/Q2W380MT
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50550593 (CHEMBL4746566) Show SMILES CC(C)(Oc1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1)C(O)=O Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<0.600	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin) in presence of 10 uM ATP				Citation and Details Article DOI: 10.1021/acs.jmedchem.8b00152 BindingDB Entry DOI: 10.7270/Q2TH8RBV
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549663 (CHEMBL4780310) Show SMILES CN1CCC(CC1)n1cc(cn1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)c(Cl)c(c3)C#N)c2c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.680	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549665 (CHEMBL4781043) Show SMILES Cn1cc(cn1)-c1ccc(cc1)-c1cnc2[nH]cc(-c3cc(NS(C)(=O)=O)cc(c3)C#N)c2c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50549688 (CHEMBL4743105) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4cccc(c4)C#N)c3c2)CC1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.910	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TNIK (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127749 BindingDB Entry DOI: 10.7270/Q2639TBB
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM579704 (N-(4-((5-(4-(1H-imidazol-1- yl)phenyl)-1H-pyrazol-...) Show SMILES Cc1cc(NS(C)(=O)=O)ccc1Nc1cc([nH]n1)-c1ccc(cc1)-n1ccnc1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11485711-20221101-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21R6VC2
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM579738 (N-(4-((5-(4-(1H-pyrazol-1- yl)phenyl)-1H-pyrazol-3...) Show SMILES Cc1cc(NC(=O)CCCl)ccc1Nc1cc([nH]n1)-c1ccc(cc1)-n1cccn1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11485711-20221101-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21R6VC2
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM579718 (3-ethyl-4-((5-(4-iodophenyl)- 1H-pyrazol-3-yl)amin...) Show SMILES CCc1cc(O)ccc1Nc1cc([nH]n1)-c1ccc(I)cc1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11485711-20221101-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21R6VC2
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM579709 (4-((5-(5-chlorothiophen-2- yl)-1H-pyrazol-3-yl)ami...) Show SMILES CCc1cc(O)ccc1Nc1cc([nH]n1)-c1ccc(Cl)s1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11485711-20221101-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21R6VC2
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM571674 (6-((5-(4-(1H-imidazol-1- yl)phenyl)-1H-pyrazol-3- ...) Show SMILES O=C1CCc2cc(Nc3cc([nH]n3)-c3ccc(cc3)-n3ccnc3)ccc2N1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11447469-20220920-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q24X5C2H
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM571620 (6-((5-(4-(1H-pyrazol-1- yl)phenyl)-1H-pyrazol-3- y...) Show SMILES O=C1CCc2cc(Nc3cc([nH]n3)-c3ccc(cc3)-n3cccn3)ccc2N1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11447469-20220920-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q24X5C2H
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM571666 (5-((5-(3-fluoro-4- hydroxyphenyl)-1H- pyrazol-3- y...) Show SMILES Oc1ccc(cc1F)-c1cc(Nc2ccc3NC(=O)Cc3c2)n[nH]1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11447469-20220920-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q24X5C2H
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM613868 (5-(1-cyclopentyl-4-(4-fluorophenyl)-1H-imidazol-5-...) Show SMILES COc1cnccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	MCE PC cid PC sid UniChem	US Patent	n/a	n/a	1.29	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174187 (US9102637, 222) Show SMILES NC1CCN(Cc2ccc(cc2)C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)CC1 Show InChI InChI=1S/C27H28N6O2S/c28-21-11-13-33(14-12-21)16-17-5-7-19(8-6-17)25(35)32-26-23(24(29)34)31-27(36-26)30-22-10-9-18-3-1-2-4-20(18)15-22/h1-10,15,21H,11-14,16,28H2,(H2,29,34)(H,30,31)(H,32,35)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.30	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50059889 ((staurosporine)3-methoxy-2-methyl-4-methylamino-(2...) Show SMILES CN[C@@H]1CC2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20?,26-,28+/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Astex Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of TNIK (unknown origin) by ADP glo luminescent assay				Bioorg Med Chem Lett 23: 569-73 (2012) Article DOI: 10.1016/j.bmcl.2012.11.013 BindingDB Entry DOI: 10.7270/Q2G73G1R
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174104 (US9102637, 139) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6](=O)-[#7]-c1sc(-[#7]-c2ccc3cc(-[#6]-[#8])ccc3c2)nc1-[#6](-[#7])=O Show InChI InChI=1S/C20H20N4O3S/c1-11(2)7-16(26)23-19-17(18(21)27)24-20(28-19)22-15-6-5-13-8-12(10-25)3-4-14(13)9-15/h3-9,25H,10H2,1-2H3,(H2,21,27)(H,22,24)(H,23,26)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.60	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM613838 (5-(1-cyclopentyl-4-(4-fluorophenyl)-1H-imidazol-5-...) Show SMILES Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccncc1F Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.96	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM613838 (5-(1-cyclopentyl-4-(4-fluorophenyl)-1H-imidazol-5-...) Show SMILES Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccncc1F Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM579739 (N-(4-((5-(4-(1H-pyrazol-1- yl)phenyl)-1H-pyrazol-3...) Show SMILES Cc1cc(NC(=O)CCN2CCOCC2)ccc1Nc1cc([nH]n1)-c1ccc(cc1)-n1cccn1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11485711-20221101-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21R6VC2
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174202 (US9102637, 237) Show SMILES Cc1nccn1Cc1ccc(cc1)C(=O)Nc1sc(Nc2ccc3ccccc3c2)nc1C(N)=O Show InChI InChI=1S/C26H22N6O2S/c1-16-28-12-13-32(16)15-17-6-8-19(9-7-17)24(34)31-25-22(23(27)33)30-26(35-25)29-21-11-10-18-4-2-3-5-20(18)14-21/h2-14H,15H2,1H3,(H2,27,33)(H,29,30)(H,31,34)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.30	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM613765 (5-(1-cyclopentyl-4-(4-fluorophenyl)-1H-imidazol-5-...) Show SMILES COc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c(OC)c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.33	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174160 (US9102637, 195) Show SMILES NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2cncn2)cc1 Show InChI InChI=1S/C24H19N7O2S/c25-21(32)20-23(30-22(33)17-7-5-15(6-8-17)12-31-14-26-13-27-31)34-24(29-20)28-19-10-9-16-3-1-2-4-18(16)11-19/h1-11,13-14H,12H2,(H2,25,32)(H,28,29)(H,30,33)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.5	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174186 (US9102637, 221) Show SMILES CN(C)[C@H]1CCN(Cc2ccc(cc2)C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)C1 |r| Show InChI InChI=1S/C28H30N6O2S/c1-33(2)23-13-14-34(17-23)16-18-7-9-20(10-8-18)26(36)32-27-24(25(29)35)31-28(37-27)30-22-12-11-19-5-3-4-6-21(19)15-22/h3-12,15,23H,13-14,16-17H2,1-2H3,(H2,29,35)(H,30,31)(H,32,36)/t23-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174150 (US9102637, 185) Show SMILES NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CCN(CCO)CC2)cc1 Show InChI InChI=1S/C28H30N6O3S/c29-25(36)24-27(38-28(31-24)30-23-10-9-20-3-1-2-4-22(20)17-23)32-26(37)21-7-5-19(6-8-21)18-34-13-11-33(12-14-34)15-16-35/h1-10,17,35H,11-16,18H2,(H2,29,36)(H,30,31)(H,32,37)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.70	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM613877 (4-(4-(5-(1-cyclopentyl-4-(4-fluorophenyl)-1H-imida...) Show SMILES C[NH+]1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c(F)c1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174196 (US9102637, 231) Show SMILES NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cc2nn[nH]n2)cc1 Show InChI InChI=1S/C23H18N8O2S/c24-20(32)19-22(27-21(33)15-7-5-13(6-8-15)11-18-28-30-31-29-18)34-23(26-19)25-17-10-9-14-3-1-2-4-16(14)12-17/h1-10,12H,11H2,(H2,24,32)(H,25,26)(H,27,33)(H,28,29,30,31)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.90	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174173 (US9102637, 208) Show SMILES NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2ccnc2)cc1 Show InChI InChI=1S/C25H20N6O2S/c26-22(32)21-24(30-23(33)18-7-5-16(6-8-18)14-31-12-11-27-15-31)34-25(29-21)28-20-10-9-17-3-1-2-4-19(17)13-20/h1-13,15H,14H2,(H2,26,32)(H,28,29)(H,30,33)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM50424547 (CHEMBL2312144) Show SMILES COc1ccc(cc1-c1ccnc(Nc2ccc(N3CCN(C)CC3)c(OC)c2)c1)C#N Show InChI InChI=1S/C25H27N5O2/c1-29-10-12-30(13-11-29)22-6-5-20(16-24(22)32-3)28-25-15-19(8-9-27-25)21-14-18(17-26)4-7-23(21)31-2/h4-9,14-16H,10-13H2,1-3H3,(H,27,28)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Astex Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of TNIK (unknown origin) by ADP glo luminescent assay				Bioorg Med Chem Lett 23: 569-73 (2012) Article DOI: 10.1016/j.bmcl.2012.11.013 BindingDB Entry DOI: 10.7270/Q2G73G1R
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174215 (US9102637, 250) Show SMILES NC(=O)c1nc(Nc2ccc3ncccc3c2)sc1NC(=O)c1ccc(Cn2ccnc2)cc1 Show InChI InChI=1S/C24H19N7O2S/c25-21(32)20-23(30-22(33)16-5-3-15(4-6-16)13-31-11-10-26-14-31)34-24(29-20)28-18-7-8-19-17(12-18)2-1-9-27-19/h1-12,14H,13H2,(H2,25,32)(H,28,29)(H,30,33)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM579689 (N-(4-((5-(4-hydroxyphenyl)- 1H-pyrazol-3-yl)amino)...) Show SMILES Cc1cc(NS(C)(=O)=O)ccc1Nc1cc([nH]n1)-c1ccc(O)cc1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11485711-20221101-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21R6VC2
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM579743 (N-(4-((5-(4-(1H-pyrazol-1- yl)phenyl)-1H-pyrazol-3...) Show SMILES Cc1cc(NS(C)(=O)=O)ccc1Nc1cc([nH]n1)-c1ccc(cc1)-n1cccn1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The inhibitory properties of compounds were evaluated with TNIK kinase enzyme system and luminescent ADP-GloFigure US11485711-20221101-P00001 Kinase ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21R6VC2
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174185 (US9102637, 220) Show SMILES N[C@H]1CCN(Cc2ccc(cc2)C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)C1 |r| Show InChI InChI=1S/C26H26N6O2S/c27-20-11-12-32(15-20)14-16-5-7-18(8-6-16)24(34)31-25-22(23(28)33)30-26(35-25)29-21-10-9-17-3-1-2-4-19(17)13-21/h1-10,13,20H,11-12,14-15,27H2,(H2,28,33)(H,29,30)(H,31,34)/t20-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM608272 (5-(1-cyclopentyl-4-(4-fluorophenyl)-1H-imidazol-5-...) Show SMILES CN1C=C(NC(=O)C2CCCCC2C(=O)c2ccc(cc2F)-c2cc(C)n[nH]2)C(C(N)=O)=[N]1C |w:12.13,5.6,c:34,t:2| Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.07	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM174203 (US9102637, 238) Show SMILES Cc1cn(Cc2ccc(cc2)C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cn1 Show InChI InChI=1S/C26H22N6O2S/c1-16-13-32(15-28-16)14-17-6-8-19(9-7-17)24(34)31-25-22(23(27)33)30-26(35-25)29-21-11-10-18-4-2-3-5-20(18)12-21/h2-13,15H,14H2,1H3,(H2,27,33)(H,29,30)(H,31,34)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.10	n/a	n/a	n/a	n/a	7.5	25
CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER US Patent					Assay Description The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...				US Patent US9102637 (2015) BindingDB Entry DOI: 10.7270/Q2KS6Q9T
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 740 total )  |  Next  |  Last  >>

Jump to: