BDBM14832 3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diazabicyclo[3.3.0]octa-2,4-diene::4-[6-(4-fluorophenyl)-2H,3H-imidazo[2,1-b][1,3]thiazol-5-yl]pyridine::CHEMBL313417::SKF 86002
SMILES: Fc1ccc(cc1)-c1nc2SCCn2c1-c1ccncc1
InChI Key: InChIKey=YOELZIQOLWZLQC-UHFFFAOYSA-N
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 |
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Mitogen-activated protein kinase 14 (Homo sapiens (Human)) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | n/a | 180 | n/a | n/a | n/a | 7.0 | 23 |
Boehringer Ingelheim Pharmaceuticals Inc. | Assay Description The exchange curve assays were run as two half-reactions using an SLM Aminco Bowman Series 2 model SQ-340 fluorescence detector. In the first half re... | Nat Struct Biol 9: 268-72 (2002) Article DOI: 10.1038/nsb770 BindingDB Entry DOI: 10.7270/Q2CV4FZ3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prostaglandin G/H synthase (cyclooxygenase) (Ovis aries (Sheep)) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 5.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
SmithKline Beecham Pharmaceuticals Curated by ChEMBL | Assay Description Inhibitory concentration against Prostaglandin H2 synthase 1 (PGHS-1) from ram seminal vesicle | J Med Chem 39: 3929-37 (1996) Article DOI: 10.1021/jm960415o BindingDB Entry DOI: 10.7270/Q29W0G4Z | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 14 (Homo sapiens (Human)) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 820 | n/a | n/a | n/a | n/a | n/a | n/a |
Chemical Genomics Centre of the Max Planck Society Curated by ChEMBL | Assay Description Displacemnt of N,N'-(2,2'-(3,3'-disulfanediylbis(2,5-dioxopyrrolidine-3,1-diyl))bis(ethane-2,1-diyl))bis(2-(3-(3-tert-butyl-5-(3-naphthalen-1-ylureid... | J Med Chem 53: 357-67 (2010) Article DOI: 10.1021/jm901297e BindingDB Entry DOI: 10.7270/Q29W0FKC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mitogen-activated protein kinase 14 (Homo sapiens (Human)) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Chemical Genomics Centre of the Max Planck Society Curated by ChEMBL | Assay Description Inhibition of p38alpha active form expressed in Escherichia coli BL21(DE3) cells by HTRF assay | J Med Chem 53: 357-67 (2010) Article DOI: 10.1021/jm901297e BindingDB Entry DOI: 10.7270/Q29W0FKC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MAP kinase p38 (Homo sapiens (Human)) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 520 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University T£bingen Curated by ChEMBL | Assay Description Inhibition of p38 MAP kinase related interleukin (IL1-beta (cytokine) release from human whole blood | J Med Chem 45: 2733-40 (2002) Article DOI: 10.1021/jm011098a BindingDB Entry DOI: 10.7270/Q2R78HZN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MAP kinase p38 (Homo sapiens (Human)) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University T£bingen Curated by ChEMBL | Assay Description Inhibition of p38 MAP kinase related TNF-alpha release from peripheral blood mononuclear cells (PBMC) | J Med Chem 45: 2733-40 (2002) Article DOI: 10.1021/jm011098a BindingDB Entry DOI: 10.7270/Q2R78HZN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MAP kinase p38 (Homo sapiens (Human)) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University T£bingen Curated by ChEMBL | Assay Description Inhibition of p38 MAP kinase related TNF-alpha release from human whole blood | J Med Chem 45: 2733-40 (2002) Article DOI: 10.1021/jm011098a BindingDB Entry DOI: 10.7270/Q2R78HZN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MAP kinase p38 (Homo sapiens (Human)) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 2.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University T£bingen Curated by ChEMBL | Assay Description Inhibition of p38 MAP kinase related interleukin (IL1-beta (cytokine) release from human whole blood | J Med Chem 45: 2733-40 (2002) Article DOI: 10.1021/jm011098a BindingDB Entry DOI: 10.7270/Q2R78HZN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Arachidonate 5-lipoxygenase (Rattus norvegicus) | BDBM14832 (3-(4-fluorophenyl)-2-pyridin-4-yl-6-thia-1,4-diaza...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
SmithKline Beecham Pharmaceuticals Curated by ChEMBL | Assay Description Inhibitory concentration against 5-lipoxygenase in rat RBL-1 cells | J Med Chem 39: 3929-37 (1996) Article DOI: 10.1021/jm960415o BindingDB Entry DOI: 10.7270/Q29W0G4Z | |||||||||||
More data for this Ligand-Target Pair |