BDBM50048197 CHEMBL143781::N-[6-(2,6-Difluoro-phenylsulfanyl)-1-oxo-indan-5-yl]-methanesulfonamide
SMILES: CS(=O)(=O)Nc1cc2CCC(=O)c2cc1Sc1c(F)cccc1F
InChI Key: InChIKey=YOULWLUHEYHUJF-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)) | BDBM50048197 (CHEMBL143781 | N-[6-(2,6-Difluoro-phenylsulfanyl)-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL | Assay Description In vitro inhibition of prostaglandin G/H synthase 2 expressed in human osteosarcoma 143 cells | J Med Chem 38: 4897-905 (1996) BindingDB Entry DOI: 10.7270/Q28051PC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cyclooxygenase-1 (COX-1) (Homo sapiens (Human)) | BDBM50048197 (CHEMBL143781 | N-[6-(2,6-Difluoro-phenylsulfanyl)-...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL | Assay Description Inhibition of Prostaglandin G/H synthase 1 in human U937 cells | J Med Chem 38: 4897-905 (1996) BindingDB Entry DOI: 10.7270/Q28051PC | |||||||||||
More data for this Ligand-Target Pair |