Compile Data Set for Download or QSAR

Found 111 hits Enz. Inhib. hit(s) with all data for entry = 50000889   

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
Aurora kinase A (Homo sapiens (Human))	BDBM50004205 (MK-045 | MK-0457 | TOZASERTIB | US9249124, VX680 |...) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKA after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50004205 (MK-045 | MK-0457 | TOZASERTIB | US9249124, VX680 |...) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKB after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM50263058 (CHEMBL4090723) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C22H26N8O2/c1-14-12-19(29-28-14)25-18-13-20(30-8-10-32-11-9-30)27-22(26-18)24-17-6-4-16(5-7-17)23-21(31)15-2-3-15/h4-7,12-13,15H,2-3,8-11H2,1H3,(H,23,31)(H3,24,25,26,27,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	167	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant RIPK1 after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM50263059 (CHEMBL4105556) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H29N9O/c1-15-13-20(30-29-15)26-19-14-21(32-11-9-31(2)10-12-32)28-23(27-19)25-18-7-5-17(6-8-18)24-22(33)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,33)(H3,25,26,27,28,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	178	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant RIPK1 after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM50004205 (MK-045 | MK-0457 | TOZASERTIB | US9249124, VX680 |...) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	208	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant RIPK1 after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50263056 (CHEMBL4064515) Show SMILES CN1CCN(CC1)c1nc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CCCCC3)cc2)n1 Show InChI InChI=1S/C25H33N9OS/c1-17-16-21(32-31-17)27-23-28-24(34-14-12-33(2)13-15-34)30-25(29-23)36-20-10-8-19(9-11-20)26-22(35)18-6-4-3-5-7-18/h8-11,16,18H,3-7,12-15H2,1-2H3,(H,26,35)(H2,27,28,29,30,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKA after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50263056 (CHEMBL4064515) Show SMILES CN1CCN(CC1)c1nc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CCCCC3)cc2)n1 Show InChI InChI=1S/C25H33N9OS/c1-17-16-21(32-31-17)27-23-28-24(34-14-12-33(2)13-15-34)30-25(29-23)36-20-10-8-19(9-11-20)26-22(35)18-6-4-3-5-7-18/h8-11,16,18H,3-7,12-15H2,1-2H3,(H,26,35)(H2,27,28,29,30,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	229	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKB after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50263059 (CHEMBL4105556) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H29N9O/c1-15-13-20(30-29-15)26-19-14-21(32-11-9-31(2)10-12-32)28-23(27-19)25-18-7-5-17(6-8-18)24-22(33)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,33)(H3,25,26,27,28,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	293	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKA after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM50263046 (CHEMBL4069729) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C23H28N8O/c1-15-13-20(30-29-15)26-19-14-21(31-11-3-2-4-12-31)28-23(27-19)25-18-9-7-17(8-10-18)24-22(32)16-5-6-16/h7-10,13-14,16H,2-6,11-12H2,1H3,(H,24,32)(H3,25,26,27,28,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	295	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant RIPK1 after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50263046 (CHEMBL4069729) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C23H28N8O/c1-15-13-20(30-29-15)26-19-14-21(31-11-3-2-4-12-31)28-23(27-19)25-18-9-7-17(8-10-18)24-22(32)16-5-6-16/h7-10,13-14,16H,2-6,11-12H2,1H3,(H,24,32)(H3,25,26,27,28,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKA after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263072 (CHEMBL4080426) Show SMILES Cc1cc(Nc2cc(nc(Sc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C25H31N7O2S/c1-17-15-22(31-30-17)27-21-16-23(32-11-13-34-14-12-32)29-25(28-21)35-20-9-7-19(8-10-20)26-24(33)18-5-3-2-4-6-18/h7-10,15-16,18H,2-6,11-14H2,1H3,(H,26,33)(H2,27,28,29,30,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263072 (CHEMBL4080426) Show SMILES Cc1cc(Nc2cc(nc(Sc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C25H31N7O2S/c1-17-15-22(31-30-17)27-21-16-23(32-11-13-34-14-12-32)29-25(28-21)35-20-9-7-19(8-10-20)26-24(33)18-5-3-2-4-6-18/h7-10,15-16,18H,2-6,11-14H2,1H3,(H,26,33)(H2,27,28,29,30,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 0.5 hrs followe...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263078 (CHEMBL4069988) Show SMILES Cc1cc(Nc2cc(nc(Sc3ccc(NC(=O)C4CC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C22H25N7O2S/c1-14-12-19(28-27-14)24-18-13-20(29-8-10-31-11-9-29)26-22(25-18)32-17-6-4-16(5-7-17)23-21(30)15-2-3-15/h4-7,12-13,15H,2-3,8-11H2,1H3,(H,23,30)(H2,24,25,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 0.5 hrs followe...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50263058 (CHEMBL4090723) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C22H26N8O2/c1-14-12-19(29-28-14)25-18-13-20(30-8-10-32-11-9-30)27-22(26-18)24-17-6-4-16(5-7-17)23-21(31)15-2-3-15/h4-7,12-13,15H,2-3,8-11H2,1H3,(H,23,31)(H3,24,25,26,27,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKA after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263058 (CHEMBL4090723) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C22H26N8O2/c1-14-12-19(29-28-14)25-18-13-20(30-8-10-32-11-9-30)27-22(26-18)24-17-6-4-16(5-7-17)23-21(31)15-2-3-15/h4-7,12-13,15H,2-3,8-11H2,1H3,(H,23,31)(H3,24,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263058 (CHEMBL4090723) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C22H26N8O2/c1-14-12-19(29-28-14)25-18-13-20(30-8-10-32-11-9-30)27-22(26-18)24-17-6-4-16(5-7-17)23-21(31)15-2-3-15/h4-7,12-13,15H,2-3,8-11H2,1H3,(H,23,31)(H3,24,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263046 (CHEMBL4069729) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C23H28N8O/c1-15-13-20(30-29-15)26-19-14-21(31-11-3-2-4-12-31)28-23(27-19)25-18-9-7-17(8-10-18)24-22(32)16-5-6-16/h7-10,13-14,16H,2-6,11-12H2,1H3,(H,24,32)(H3,25,26,27,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 0.5 hrs followe...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263163 (CHEMBL4099814) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C25H32N8O2/c1-17-15-22(32-31-17)28-21-16-23(33-11-13-35-14-12-33)30-25(29-21)27-20-9-7-19(8-10-20)26-24(34)18-5-3-2-4-6-18/h7-10,15-16,18H,2-6,11-14H2,1H3,(H,26,34)(H3,27,28,29,30,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 0.5 hrs followe...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263059 (CHEMBL4105556) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H29N9O/c1-15-13-20(30-29-15)26-19-14-21(32-11-9-31(2)10-12-32)28-23(27-19)25-18-7-5-17(6-8-18)24-22(33)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,33)(H3,25,26,27,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263046 (CHEMBL4069729) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C23H28N8O/c1-15-13-20(30-29-15)26-19-14-21(31-11-3-2-4-12-31)28-23(27-19)25-18-9-7-17(8-10-18)24-22(32)16-5-6-16/h7-10,13-14,16H,2-6,11-12H2,1H3,(H,24,32)(H3,25,26,27,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263089 (CHEMBL4077434) Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nc(n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C21H24N8O2S/c1-13-12-17(28-27-13)23-19-24-20(29-8-10-31-11-9-29)26-21(25-19)32-16-6-4-15(5-7-16)22-18(30)14-2-3-14/h4-7,12,14H,2-3,8-11H2,1H3,(H,22,30)(H2,23,24,25,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM50263057 (CHEMBL381230) Show SMILES CN1C(=O)NC(Cc2c[nH]c3c(Cl)cccc23)C1=O Show InChI InChI=1S/C13H12ClN3O2/c1-17-12(18)10(16-13(17)19)5-7-6-15-11-8(7)3-2-4-9(11)14/h2-4,6,10,15H,5H2,1H3,(H,16,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	754	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant RIPK1 after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263078 (CHEMBL4069988) Show SMILES Cc1cc(Nc2cc(nc(Sc3ccc(NC(=O)C4CC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C22H25N7O2S/c1-14-12-19(28-27-14)24-18-13-20(29-8-10-31-11-9-29)26-22(25-18)32-17-6-4-16(5-7-17)23-21(30)15-2-3-15/h4-7,12-13,15H,2-3,8-11H2,1H3,(H,23,30)(H2,24,25,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	810	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50263058 (CHEMBL4090723) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C22H26N8O2/c1-14-12-19(29-28-14)25-18-13-20(30-8-10-32-11-9-30)27-22(26-18)24-17-6-4-16(5-7-17)23-21(31)15-2-3-15/h4-7,12-13,15H,2-3,8-11H2,1H3,(H,23,31)(H3,24,25,26,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	853	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKB after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263085 (CHEMBL4102307) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(NC(=O)C3CCCCC3)cc2)n1 Show InChI InChI=1S/C26H35N9O/c1-18-16-23(33-32-18)29-22-17-24(35-14-12-34(2)13-15-35)31-26(30-22)28-21-10-8-20(9-11-21)27-25(36)19-6-4-3-5-7-19/h8-11,16-17,19H,3-7,12-15H2,1-2H3,(H,27,36)(H3,28,29,30,31,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 0.5 hrs followe...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50263046 (CHEMBL4069729) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C23H28N8O/c1-15-13-20(30-29-15)26-19-14-21(31-11-3-2-4-12-31)28-23(27-19)25-18-9-7-17(8-10-18)24-22(32)16-5-6-16/h7-10,13-14,16H,2-6,11-12H2,1H3,(H,24,32)(H3,25,26,27,28,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	959	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKB after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50004205 (MK-045 | MK-0457 | TOZASERTIB | US9249124, VX680 |...) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 0.5 hrs followe...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50004205 (MK-045 | MK-0457 | TOZASERTIB | US9249124, VX680 |...) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263059 (CHEMBL4105556) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H29N9O/c1-15-13-20(30-29-15)26-19-14-21(32-11-9-31(2)10-12-32)28-23(27-19)25-18-7-5-17(6-8-18)24-22(33)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,33)(H3,25,26,27,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263159 (CHEMBL4065014) Show SMILES Cc1cc(Nc2nc(Nc3ccc(NC(=O)C4CC4)cc3)nc(n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C21H25N9O2/c1-13-12-17(29-28-13)24-20-25-19(26-21(27-20)30-8-10-32-11-9-30)23-16-6-4-15(5-7-16)22-18(31)14-2-3-14/h4-7,12,14H,2-3,8-11H2,1H3,(H,22,31)(H3,23,24,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263164 (CHEMBL4086975) Show SMILES CN1CCN(CC1)c1nc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C22H27N9OS/c1-14-13-18(29-28-14)24-20-25-21(31-11-9-30(2)10-12-31)27-22(26-20)33-17-7-5-16(6-8-17)23-19(32)15-3-4-15/h5-8,13,15H,3-4,9-12H2,1-2H3,(H,23,32)(H2,24,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50263059 (CHEMBL4105556) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H29N9O/c1-15-13-20(30-29-15)26-19-14-21(32-11-9-31(2)10-12-32)28-23(27-19)25-18-7-5-17(6-8-18)24-22(33)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,33)(H3,25,26,27,28,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKB after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263089 (CHEMBL4077434) Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nc(n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C21H24N8O2S/c1-13-12-17(28-27-13)23-19-24-20(29-8-10-31-11-9-29)26-21(25-19)32-16-6-4-15(5-7-16)22-18(30)14-2-3-14/h4-7,12,14H,2-3,8-11H2,1H3,(H,22,30)(H2,23,24,25,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.45E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263163 (CHEMBL4099814) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C25H32N8O2/c1-17-15-22(32-31-17)28-21-16-23(33-11-13-35-14-12-33)30-25(29-21)27-20-9-7-19(8-10-20)26-24(34)18-5-3-2-4-6-18/h7-10,15-16,18H,2-6,11-14H2,1H3,(H,26,34)(H3,27,28,29,30,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263099 (CHEMBL4084466) Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CCCCC4)cc3)nc(n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C24H30N8O2S/c1-16-15-20(31-30-16)26-22-27-23(32-11-13-34-14-12-32)29-24(28-22)35-19-9-7-18(8-10-19)25-21(33)17-5-3-2-4-6-17/h7-10,15,17H,2-6,11-14H2,1H3,(H,25,33)(H2,26,27,28,29,30,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263079 (CHEMBL4089624) Show SMILES Cc1cc(Nc2cc(nc(Sc3ccc(NC(=O)C4CC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C23H27N7OS/c1-15-13-20(29-28-15)25-19-14-21(30-11-3-2-4-12-30)27-23(26-19)32-18-9-7-17(8-10-18)24-22(31)16-5-6-16/h7-10,13-14,16H,2-6,11-12H2,1H3,(H,24,31)(H2,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263079 (CHEMBL4089624) Show SMILES Cc1cc(Nc2cc(nc(Sc3ccc(NC(=O)C4CC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C23H27N7OS/c1-15-13-20(29-28-15)25-19-14-21(30-11-3-2-4-12-30)27-23(26-19)32-18-9-7-17(8-10-18)24-22(31)16-5-6-16/h7-10,13-14,16H,2-6,11-12H2,1H3,(H,24,31)(H2,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263085 (CHEMBL4102307) Show SMILES CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc(NC(=O)C3CCCCC3)cc2)n1 Show InChI InChI=1S/C26H35N9O/c1-18-16-23(33-32-18)29-22-17-24(35-14-12-34(2)13-15-35)31-26(30-22)28-21-10-8-20(9-11-21)27-25(36)19-6-4-3-5-7-19/h8-11,16-17,19H,3-7,12-15H2,1-2H3,(H,27,36)(H3,28,29,30,31,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263161 (CHEMBL4064167) Show SMILES Cc1cc(Nc2cc(nc(Sc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C26H33N7OS/c1-18-16-23(32-31-18)28-22-17-24(33-14-6-3-7-15-33)30-26(29-22)35-21-12-10-20(11-13-21)27-25(34)19-8-4-2-5-9-19/h10-13,16-17,19H,2-9,14-15H2,1H3,(H,27,34)(H2,28,29,30,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 0.5 hrs followe...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263084 (CHEMBL4081804) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C26H34N8O/c1-18-16-23(33-32-18)29-22-17-24(34-14-6-3-7-15-34)31-26(30-22)28-21-12-10-20(11-13-21)27-25(35)19-8-4-2-5-9-19/h10-13,16-17,19H,2-9,14-15H2,1H3,(H,27,35)(H3,28,29,30,31,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.94E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM50263056 (CHEMBL4064515) Show SMILES CN1CCN(CC1)c1nc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CCCCC3)cc2)n1 Show InChI InChI=1S/C25H33N9OS/c1-17-16-21(32-31-17)27-23-28-24(34-14-12-33(2)13-15-34)30-25(29-23)36-20-10-8-19(9-11-20)26-22(35)18-6-4-3-5-7-18/h8-11,16,18H,3-7,12-15H2,1-2H3,(H,26,35)(H2,27,28,29,30,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	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
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant RIPK1 after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263159 (CHEMBL4065014) Show SMILES Cc1cc(Nc2nc(Nc3ccc(NC(=O)C4CC4)cc3)nc(n2)N2CCOCC2)n[nH]1 Show InChI InChI=1S/C21H25N9O2/c1-13-12-17(29-28-13)24-20-25-19(26-21(27-20)30-8-10-32-11-9-30)23-16-6-4-15(5-7-16)22-18(31)14-2-3-14/h4-7,12,14H,2-3,8-11H2,1H3,(H,22,31)(H3,23,24,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.64E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50263057 (CHEMBL381230) Show SMILES CN1C(=O)NC(Cc2c[nH]c3c(Cl)cccc23)C1=O Show InChI InChI=1S/C13H12ClN3O2/c1-17-12(18)10(16-13(17)19)5-7-6-15-11-8(7)3-2-4-9(11)14/h2-4,6,10,15H,5H2,1H3,(H,16,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKA after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50263057 (CHEMBL381230) Show SMILES CN1C(=O)NC(Cc2c[nH]c3c(Cl)cccc23)C1=O Show InChI InChI=1S/C13H12ClN3O2/c1-17-12(18)10(16-13(17)19)5-7-6-15-11-8(7)3-2-4-9(11)14/h2-4,6,10,15H,5H2,1H3,(H,16,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of human recombinant AurKB after 4 hrs by ADP-Glo assay				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263080 (CHEMBL4075303) Show SMILES Cc1[nH]nc(Nc2cc(nc(Sc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCOCC2)c1C Show InChI InChI=1S/C26H33N7O2S/c1-17-18(2)31-32-24(17)28-22-16-23(33-12-14-35-15-13-33)30-26(29-22)36-21-10-8-20(9-11-21)27-25(34)19-6-4-3-5-7-19/h8-11,16,19H,3-7,12-15H2,1-2H3,(H,27,34)(H2,28,29,30,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263084 (CHEMBL4081804) Show SMILES Cc1cc(Nc2cc(nc(Nc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCCCC2)n[nH]1 Show InChI InChI=1S/C26H34N8O/c1-18-16-23(33-32-18)29-22-17-24(34-14-6-3-7-15-34)31-26(30-22)28-21-12-10-20(11-13-21)27-25(35)19-8-4-2-5-9-19/h10-13,16-17,19H,2-9,14-15H2,1H3,(H,27,35)(H3,28,29,30,31,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263086 (CHEMBL4083590) Show SMILES Cc1[nH]nc(Nc2cc(nc(Nc3ccc(NC(=O)C4CCCCC4)cc3)n2)N2CCCCC2)c1C Show InChI InChI=1S/C27H36N8O/c1-18-19(2)33-34-25(18)30-23-17-24(35-15-7-4-8-16-35)32-27(31-23)29-22-13-11-21(12-14-22)28-26(36)20-9-5-3-6-10-20/h11-14,17,20H,3-10,15-16H2,1-2H3,(H,28,36)(H3,29,30,31,32,33,34)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263087 (CHEMBL4070219) Show SMILES CN1CCN(CC1)c1cc(Nc2n[nH]c(C)c2C)nc(Nc2ccc(NC(=O)C3CCCCC3)cc2)n1 Show InChI InChI=1S/C27H37N9O/c1-18-19(2)33-34-25(18)30-23-17-24(36-15-13-35(3)14-16-36)32-27(31-23)29-22-11-9-21(10-12-22)28-26(37)20-7-5-4-6-8-20/h9-12,17,20H,4-8,13-16H2,1-3H3,(H,28,37)(H3,29,30,31,32,33,34)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263097 (CHEMBL4094672) Show SMILES Cc1[nH]nc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nc(n2)N2CCOCC2)c1C Show InChI InChI=1S/C22H26N8O2S/c1-13-14(2)28-29-18(13)24-20-25-21(30-9-11-32-12-10-30)27-22(26-20)33-17-7-5-16(6-8-17)23-19(31)15-3-4-15/h5-8,15H,3-4,9-12H2,1-2H3,(H,23,31)(H2,24,25,26,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Mus musculus)	BDBM50263098 (CHEMBL4074165) Show SMILES CN1CCN(CC1)c1nc(Nc2n[nH]c(C)c2C)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1 Show InChI InChI=1S/C23H29N9OS/c1-14-15(2)29-30-19(14)25-21-26-22(32-12-10-31(3)11-13-32)28-23(27-21)34-18-8-6-17(7-9-18)24-20(33)16-4-5-16/h6-9,16H,4-5,10-13H2,1-3H3,(H,24,33)(H2,25,26,27,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry , University of Antwerp , Universiteitsplein 1 , Wilrijk-Antwerp 2610 , Belgium. Curated by ChEMBL					Assay Description Inhibition of RIPK1 in mouse L929sA cells transfected with human Fas assessed as inhibition in TNF-induced necroptosis pretreated for 24 hrs followed...				J Med Chem 61: 1895-1920 (2018) Article DOI: 10.1021/acs.jmedchem.7b01449 BindingDB Entry DOI: 10.7270/Q2930WNQ
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 111 total )  |  Next  |  Last  >>

Jump to: