BDBM50158441 CHEMBL224693::N-[3-(3-chlorophenoxy)-4-pyridinyl]trifluoromethanesulfonamide
SMILES: FC(F)(F)S(=O)(=O)Nc1ccncc1Oc1cccc(Cl)c1
InChI Key: InChIKey=DBTIALADKQUNTD-UHFFFAOYSA-N
Data: 2 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cyclooxygenase (Homo sapiens (Human)) | BDBM50158441![]() (CHEMBL224693 | N-[3-(3-chlorophenoxy)-4-pyridinyl]...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Liège Curated by ChEMBL | Assay Description Inhibition of COX2 in human whole blood assessed as inhibition of LPS-stimulated PGE2 production | J Med Chem 47: 6749-59 (2004) Article DOI: 10.1021/jm049480l BindingDB Entry DOI: 10.7270/Q2FF3RVK | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cyclooxygenase-1 (COX-1) (Homo sapiens (Human)) | BDBM50158441![]() (CHEMBL224693 | N-[3-(3-chlorophenoxy)-4-pyridinyl]...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Liège Curated by ChEMBL | Assay Description Inhibition of COX1 in human whole blood assessed as inhibition of calcium ionophore A-23187-stimulated platelet aggregation by measuring TXB2 product... | J Med Chem 47: 6749-59 (2004) Article DOI: 10.1021/jm049480l BindingDB Entry DOI: 10.7270/Q2FF3RVK | |||||||||||
More data for this Ligand-Target Pair |