BindingDB PrimarySearch

BDBM50206421 3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)isoxazole::4-(3-(4-fluorophenyl)-5-isopropylisoxazol-4-yl)pyridine::4-[3-(4-fluorophenyl)-5-isopropylisoxazol-4-yl]pyridine::CHEMBL220227

SMILES: CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1

InChI Key: InChIKey=BOCQIRYQTWRJMD-UHFFFAOYSA-N

Data: 10 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50206421
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Mitogen-activated protein kinase 10 (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Tübingen Curated by ChEMBL					Assay Description Inhibition of JNK3 by non-radioactive immunosorbent assay				J Med Chem 50: 1213-21 (2007) Article DOI: 10.1021/jm061097o BindingDB Entry DOI: 10.7270/Q2QZ29NS
Eberhard-Karls-University Tübingen Curated by ChEMBL					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Tübingen Curated by ChEMBL					Assay Description Inhibition of p38alpha MAPK by non-radioactive immunosorbent assay				J Med Chem 50: 1213-21 (2007) Article DOI: 10.1021/jm061097o BindingDB Entry DOI: 10.7270/Q2QZ29NS
Eberhard-Karls-University Tübingen Curated by ChEMBL					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Curated by ChEMBL					Assay Description Inhibition of p38alpha				Bioorg Med Chem Lett 18: 1431-5 (2008) Article DOI: 10.1016/j.bmcl.2007.12.073 BindingDB Entry DOI: 10.7270/Q208652M
Eberhard-Karls-University Curated by ChEMBL					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 9 (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Curated by ChEMBL					Assay Description Inhibition of JNK2				Bioorg Med Chem Lett 18: 1431-5 (2008) Article DOI: 10.1016/j.bmcl.2007.12.073 BindingDB Entry DOI: 10.7270/Q208652M
Eberhard-Karls-University Curated by ChEMBL					More data for this Ligand-Target Pair
Casein kinase I delta (Rattus norvegicus (rat))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Curated by ChEMBL					Assay Description Inhibition of GST-fused rat CK1delta by Cherenkov counting in presence of 20 uM ATP				J Med Chem 52: 7618-30 (2009) Article DOI: 10.1021/jm9005127 BindingDB Entry DOI: 10.7270/Q28K7961
Eberhard-Karls-University Curated by ChEMBL					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Curated by ChEMBL					Assay Description Inhibition of p38alpha by Cherenkov counting				J Med Chem 52: 7618-30 (2009) Article DOI: 10.1021/jm9005127 BindingDB Entry DOI: 10.7270/Q28K7961
Eberhard-Karls-University Curated by ChEMBL					More data for this Ligand-Target Pair
Casein kinase I isoform delta (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Curated by ChEMBL					Assay Description Inhibition of CK1delta by Cherenkov counting in presence of 20 uM ATP				J Med Chem 52: 7618-30 (2009) Article DOI: 10.1021/jm9005127 BindingDB Entry DOI: 10.7270/Q28K7961
Eberhard-Karls-University Curated by ChEMBL					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 9 (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Curated by ChEMBL					Assay Description Inhibition of JNK2 by Cherenkov counting in presence of 20 uM ATP				J Med Chem 52: 7618-30 (2009) Article DOI: 10.1021/jm9005127 BindingDB Entry DOI: 10.7270/Q28K7961
Eberhard-Karls-University Curated by ChEMBL					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 10 (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Curated by ChEMBL					Assay Description Inhibition of JNK3 by Cherenkov counting in presence of 20 uM ATP				J Med Chem 52: 7618-30 (2009) Article DOI: 10.1021/jm9005127 BindingDB Entry DOI: 10.7270/Q28K7961
Eberhard-Karls-University Curated by ChEMBL					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 10 (Homo sapiens (Human))	BDBM50206421 (3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...) Show SMILES CC(C)c1onc(c1-c1ccncc1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls-University Curated by ChEMBL					Assay Description Inhibition of JNK3				Bioorg Med Chem Lett 18: 1431-5 (2008) Article DOI: 10.1016/j.bmcl.2007.12.073 BindingDB Entry DOI: 10.7270/Q208652M
Eberhard-Karls-University Curated by ChEMBL					More data for this Ligand-Target Pair